A3530/0149542
TL;DR: A3530/0149542 (CAS 695205-83-5) is a chemical compound with molecular formula C18H15N5O3S and molecular weight 381.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)amino]carbamothioyl]pyridine-3-carboxamide
Also Known As: A3530/0149542, N-(2-(5-methyl-3-phenylisoxazole-4-carbonyl)hydrazinecarbonothioyl)nicotinamide, N-[[(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)amino]carbamothioyl]pyridine-3-carboxamide, N-({2-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)carbonyl]hydrazinyl}carbonothioyl)pyridine-3-carboxamide
| Molecular Formula | C18H15N5O3S |
|---|---|
| Molecular Weight | 381.09 g/mol |
| LogP | 1.99432 |
| Topological Polar Surface Area | 109.15 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 381.08957 |
| Heavy Atoms | 27 |
| Complexity | 973.1769 |
Chemical Identifiers
| CAS Number | 695205-83-5 |
|---|---|
| SMILES | CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NNC(=S)NC(=O)C3=CN=CC=C3 |
Product Overview
A3530/0149542 (CAS 695205-83-5), with molecular formula C18H15N5O3S and molecular weight 381.09 g/mol. IUPAC: N-[[(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)amino]carbamothioyl]pyridine-3-carboxamide.
Chemical Property Profile of A3530/0149542
Property Insights of A3530/0149542
The XLogP value of 1.99432 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A3530/0149542. The TPSA of 109.15 Ų falls within the moderate polarity range, balancing permeability and solubility for A3530/0149542. Following Lipinski's Rule of Five, A3530/0149542 has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A3530/0149542?
The CAS number of A3530/0149542 is 695205-83-5.
What is the molecular formula of A3530/0149542?
The molecular formula of A3530/0149542 is C18H15N5O3S.
What is the molecular weight of A3530/0149542?
The molecular weight of A3530/0149542 is 381.09 g/mol.
Where can I buy A3530/0149542?
You can request a quote for A3530/0149542 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3530/0149542?
Yes, KEHONG BIO provides custom synthesis services for A3530/0149542 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.