Pradimicin A amide
TL;DR: Pradimicin A amide (CAS 133917-50-7) is a chemical compound with molecular formula C40H45N3O17 and molecular weight 839.2749 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(1-amino-1-oxopropan-2-yl)-1,6,9,14-tetrahydroxy-5-[3-hydroxy-6-methyl-5-(methylamino)-4-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-11-methoxy-3-methyl-8,13-dioxo-5,6-dihydrobenzo[a]tetracene-2-carboxamide
Also Known As: Pradimicin A amide, Pradimicin der., Benzo(a)naphthacene-2-carboxamide, N-(2-amino-1-methyl-2-oxoethyl)-5-((4,6-dideoxy-4-(methylamino)-3-O-beta-D-xylopyranosyl-beta-D-galactopyranosyl)oxy)-5,6,8,13-tetrahydro-1,6,9,14-tetrahydroxy-11-methoxy-3-methyl-8,13-dioxo-, (5S-(2(S*),5-alpha,6-beta))-, 5-{[4,6-Dideoxy-4-(methylamino)-3-O-pentopyranosylhexopyranosyl]oxy}-1,6,9,14-tetrahydroxy-N-(1-hydroxy-1-iminopropan-2-yl)-11-methoxy-3-methyl-8,13-dioxo-5,6,8,13-tetrahydrobenzo[a]tetracene-2-carboximidic acid, N-(1-amino-1-oxopropan-2-yl)-1,6,9,14-tetrahydroxy-5-[3-hydroxy-6-methyl-5-(methylamino)-4-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-11-methoxy-3-methyl-8,13-dioxo-5,6-dihydrobenzo[a]tetracene-2-carboxamide
Technical Specifications
| Molecular Formula | C40H45N3O17 |
| Molecular Weight | 839.2749 g/mol |
| XLogP | -0.3 |
| Topological Polar Surface Area (TPSA) | 326.0 Ų |
| Hydrogen Bond Donors | 11 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 9 |
| Exact Mass | 839.2749 Da |
| Heavy Atoms | 60 |
| Complexity | 1610.0 |
| SMILES | CC1C(C(C(C(O1)OC2C(C3=CC4=C(C(=C3C5=C2C=C(C(=C5O)C(=O)NC(C)C(=O)N)C)O)C(=O)C6=C(C4=O)C(=CC(=C6)OC)O)O)O)OC7C(C(C(CO7)O)O)O)NC |
| InChIKey | HFZYHAGDSBUGMD-UHFFFAOYSA-N |
Chemical Property Profile of Pradimicin A amide
Property Insights of Pradimicin A amide
The XLogP value of -0.3 indicates that Pradimicin A amide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 326.0 Ų indicates high polarity, suggesting Pradimicin A amide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Pradimicin A amide has 11 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Pradimicin A amide?
The CAS number of Pradimicin A amide is 133917-50-7.
What is the molecular formula of Pradimicin A amide?
The molecular formula of Pradimicin A amide is C40H45N3O17.
What is the molecular weight of Pradimicin A amide?
The molecular weight of Pradimicin A amide is 839.2749 g/mol.
Where can I buy Pradimicin A amide?
You can request a quote for Pradimicin A amide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Pradimicin A amide?
Yes, CoreyChem provides custom synthesis services for Pradimicin A amide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.