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5,5a,6a,7,8,9,10,10a-octahydro-4H-[1,2,5]oxadiazolo[3,4-c]carbazole-6,10b-diol 3-oxide structure
Fine Chemical

5,5a,6a,7,8,9,10,10a-octahydro-4H-[1,2,5]oxadiazolo[3,4-c]carbazole-6,10b-diol 3-oxide

TL;DR: 5,5a,6a,7,8,9,10,10a-octahydro-4H-[1,2,5]oxadiazolo[3,4-c]carbazole-6,10b-diol 3-oxide (CAS 302553-81-7) is a chemical compound with molecular formula C12H17N3O4 and molecular weight 267.12192 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

6-hydroxy-3-oxido-5,5a,6a,7,8,9,10,10a-octahydro-4H-[1,2,5]oxadiazolo[3,4-c]carbazol-3-ium-10b-ol

Also Known As: 5,5a,6a,7,8,9,10,10a-octahydro-4H-[1,2,5]oxadiazolo[3,4-c]carbazole-6,10b-diol 3-oxide, 6,10b-dihydroxy-5,5a,6,6a,7,8,9,10,10a,10b-decahydro-4H-[1,2,5]oxadiazolo[3,4-c]carbazole 3-oxide, 6-hydroxy-3-oxido-5,5a,6a,7,8,9,10,10a-octahydro-4H-[1,2,5]oxadiazolo[3,4-c]carbazol-3-ium-10b-ol

CAS Number
302553-81-7
Molecular Formula
C12H17N3O4
Molecular Weight
267.12192 g/mol
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Technical Specifications

Molecular FormulaC12H17N3O4
Molecular Weight267.12192 g/mol
XLogP0.5
Topological Polar Surface Area (TPSA)95.2 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors6
Rotatable Bonds0
Exact Mass267.12192 Da
Heavy Atoms19
Complexity384.0
SMILESC1CCC2C(C1)C3(C(N2O)CCC4=[N+](ON=C43)[O-])O
InChIKeyUCVCSJWSCKNRFP-UHFFFAOYSA-N

Chemical Property Profile of 5,5a,6a,7,8,9,10,10a-octahydro-4H-[1,2,5]oxadiazolo[3,4-c]carbazole-6,10b-diol 3-oxide

XLogP
0.5
TPSA (Topological Polar Surface Area)
95.2
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
6
Rotatable Bonds
0
Heavy Atoms
19
Complexity
384.0
Exact Mass
267.12192
Monoisotopic Mass
267.12192
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 5,5a,6a,7,8,9,10,10a-octahydro-4H-[1,2,5]oxadiazolo[3,4-c]carbazole-6,10b-diol 3-oxide

The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,5a,6a,7,8,9,10,10a-octahydro-4H-[1,2,5]oxadiazolo[3,4-c]carbazole-6,10b-diol 3-oxide. The TPSA of 95.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,5a,6a,7,8,9,10,10a-octahydro-4H-[1,2,5]oxadiazolo[3,4-c]carbazole-6,10b-diol 3-oxide. Following Lipinski's Rule of Five, 5,5a,6a,7,8,9,10,10a-octahydro-4H-[1,2,5]oxadiazolo[3,4-c]carbazole-6,10b-diol 3-oxide has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 5,5a,6a,7,8,9,10,10a-octahydro-4H-[1,2,5]oxadiazolo[3,4-c]carbazole-6,10b-diol 3-oxide?

The CAS number of 5,5a,6a,7,8,9,10,10a-octahydro-4H-[1,2,5]oxadiazolo[3,4-c]carbazole-6,10b-diol 3-oxide is 302553-81-7.

What is the molecular formula of 5,5a,6a,7,8,9,10,10a-octahydro-4H-[1,2,5]oxadiazolo[3,4-c]carbazole-6,10b-diol 3-oxide?

The molecular formula of 5,5a,6a,7,8,9,10,10a-octahydro-4H-[1,2,5]oxadiazolo[3,4-c]carbazole-6,10b-diol 3-oxide is C12H17N3O4.

What is the molecular weight of 5,5a,6a,7,8,9,10,10a-octahydro-4H-[1,2,5]oxadiazolo[3,4-c]carbazole-6,10b-diol 3-oxide?

The molecular weight of 5,5a,6a,7,8,9,10,10a-octahydro-4H-[1,2,5]oxadiazolo[3,4-c]carbazole-6,10b-diol 3-oxide is 267.12192 g/mol.

Where can I buy 5,5a,6a,7,8,9,10,10a-octahydro-4H-[1,2,5]oxadiazolo[3,4-c]carbazole-6,10b-diol 3-oxide?

You can request a quote for 5,5a,6a,7,8,9,10,10a-octahydro-4H-[1,2,5]oxadiazolo[3,4-c]carbazole-6,10b-diol 3-oxide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 5,5a,6a,7,8,9,10,10a-octahydro-4H-[1,2,5]oxadiazolo[3,4-c]carbazole-6,10b-diol 3-oxide?

Yes, CoreyChem provides custom synthesis services for 5,5a,6a,7,8,9,10,10a-octahydro-4H-[1,2,5]oxadiazolo[3,4-c]carbazole-6,10b-diol 3-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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