A3530/0149535
TL;DR: A3530/0149535 (CAS 695205-76-6) is a chemical compound with molecular formula C19H15ClN4O3S and molecular weight 414.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-[[(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)amino]carbamothioyl]benzamide
Also Known As: A3530/0149535, 4-chloro-N-[[(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)amino]carbamothioyl]benzamide, 4-chloro-N-(2-(5-methyl-3-phenylisoxazole-4-carbonyl)hydrazinecarbonothioyl)benzamide, 4-chloro-N-({2-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)carbonyl]hydrazinyl}carbonothioyl)benzamide, 4-CHLORO-N~1~-({2-[(5-METHYL-3-PHENYL-4-ISOXAZOLYL)CARBONYL]HYDRAZINO}CARBOTHIOYL)BENZAMIDE
| Molecular Formula | C19H15ClN4O3S |
|---|---|
| Molecular Weight | 414.06 g/mol |
| LogP | 3.25272 |
| Topological Polar Surface Area | 96.26 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 414.05533 |
| Heavy Atoms | 28 |
| Complexity | 1019.41785 |
Chemical Identifiers
| CAS Number | 695205-76-6 |
|---|---|
| SMILES | CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NNC(=S)NC(=O)C3=CC=C(C=C3)Cl |
Product Overview
A3530/0149535 (CAS 695205-76-6), with molecular formula C19H15ClN4O3S and molecular weight 414.06 g/mol. IUPAC: 4-chloro-N-[[(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)amino]carbamothioyl]benzamide.
Chemical Property Profile of A3530/0149535
Property Insights of A3530/0149535
The XLogP value of 3.25272 indicates that A3530/0149535 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.26 Ų falls within the moderate polarity range, balancing permeability and solubility for A3530/0149535. Following Lipinski's Rule of Five, A3530/0149535 has 3 hydrogen bond donor(s) and 5 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 A3530/0149535?
The CAS number of A3530/0149535 is 695205-76-6.
What is the molecular formula of A3530/0149535?
The molecular formula of A3530/0149535 is C19H15ClN4O3S.
What is the molecular weight of A3530/0149535?
The molecular weight of A3530/0149535 is 414.06 g/mol.
Where can I buy A3530/0149535?
You can request a quote for A3530/0149535 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3530/0149535?
Yes, KEHONG BIO provides custom synthesis services for A3530/0149535 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.