![N-((2-methyl-5-(oxazolo[4,5-b]pyridin-2-yl)phenyl)carbamothioyl)-4-nitrobenzamide structure](/static/products/461/461028-74-0.webp)
N-((2-methyl-5-(oxazolo[4,5-b]pyridin-2-yl)phenyl)carbamothioyl)-4-nitrobenzamide
TL;DR: N-((2-methyl-5-(oxazolo[4,5-b]pyridin-2-yl)phenyl)carbamothioyl)-4-nitrobenzamide (CAS 461028-74-0) is a chemical compound with molecular formula C21H15N5O4S and molecular weight 433.08447 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl]-4-nitrobenzamide
Also Known As: N-((2-methyl-5-(oxazolo[4,5-b]pyridin-2-yl)phenyl)carbamothioyl)-4-nitrobenzamide, N-[[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl]-4-nitrobenzamide, N-{[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl}-4-nitrobenzamide
Technical Specifications
| Molecular Formula | C21H15N5O4S |
| Molecular Weight | 433.08447 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 158.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 433.08447 Da |
| Heavy Atoms | 31 |
| Complexity | 681.0 |
| SMILES | CC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC=N3)NC(=S)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-] |
| InChIKey | LRTUMDQLMVOVKI-UHFFFAOYSA-N |
Chemical Property Profile of N-((2-methyl-5-(oxazolo[4,5-b]pyridin-2-yl)phenyl)carbamothioyl)-4-nitrobenzamide
Property Insights of N-((2-methyl-5-(oxazolo[4,5-b]pyridin-2-yl)phenyl)carbamothioyl)-4-nitrobenzamide
The XLogP value of 4.5 indicates that N-((2-methyl-5-(oxazolo[4,5-b]pyridin-2-yl)phenyl)carbamothioyl)-4-nitrobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 158.0 Ų indicates high polarity, suggesting N-((2-methyl-5-(oxazolo[4,5-b]pyridin-2-yl)phenyl)carbamothioyl)-4-nitrobenzamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-((2-methyl-5-(oxazolo[4,5-b]pyridin-2-yl)phenyl)carbamothioyl)-4-nitrobenzamide has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-((2-methyl-5-(oxazolo[4,5-b]pyridin-2-yl)phenyl)carbamothioyl)-4-nitrobenzamide?
The CAS number of N-((2-methyl-5-(oxazolo[4,5-b]pyridin-2-yl)phenyl)carbamothioyl)-4-nitrobenzamide is 461028-74-0.
What is the molecular formula of N-((2-methyl-5-(oxazolo[4,5-b]pyridin-2-yl)phenyl)carbamothioyl)-4-nitrobenzamide?
The molecular formula of N-((2-methyl-5-(oxazolo[4,5-b]pyridin-2-yl)phenyl)carbamothioyl)-4-nitrobenzamide is C21H15N5O4S.
What is the molecular weight of N-((2-methyl-5-(oxazolo[4,5-b]pyridin-2-yl)phenyl)carbamothioyl)-4-nitrobenzamide?
The molecular weight of N-((2-methyl-5-(oxazolo[4,5-b]pyridin-2-yl)phenyl)carbamothioyl)-4-nitrobenzamide is 433.08447 g/mol.
Where can I buy N-((2-methyl-5-(oxazolo[4,5-b]pyridin-2-yl)phenyl)carbamothioyl)-4-nitrobenzamide?
You can request a quote for N-((2-methyl-5-(oxazolo[4,5-b]pyridin-2-yl)phenyl)carbamothioyl)-4-nitrobenzamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-((2-methyl-5-(oxazolo[4,5-b]pyridin-2-yl)phenyl)carbamothioyl)-4-nitrobenzamide?
Yes, CoreyChem provides custom synthesis services for N-((2-methyl-5-(oxazolo[4,5-b]pyridin-2-yl)phenyl)carbamothioyl)-4-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.