A3530/0149530
TL;DR: A3530/0149530 (CAS 695205-72-2) is a chemical compound with molecular formula C17H14N4O3S2 and molecular weight 386.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-3-phenyl-N-[(thiophene-2-carbonylamino)carbamothioyl]-1,2-oxazole-4-carboxamide
Also Known As: A3530/0149530, 5-methyl-3-phenyl-N-(2-(thiophene-2-carbonyl)hydrazinecarbonothioyl)isoxazole-4-carboxamide, 5-methyl-3-phenyl-N-[(thiophene-2-carbonylamino)carbamothioyl]-1,2-oxazole-4-carboxamide, 5-methyl-3-phenyl-N-{[2-(thiophen-2-ylcarbonyl)hydrazinyl]carbonothioyl}-1,2-oxazole-4-carboxamide, 5-METHYL-3-PHENYL-N~4~-{[2-(2-THIENYLCARBONYL)HYDRAZINO]CARBOTHIOYL}-4-ISOXAZOLECARBOXAMIDE
| Molecular Formula | C17H14N4O3S2 |
|---|---|
| Molecular Weight | 386.05 g/mol |
| LogP | 2.66082 |
| Topological Polar Surface Area | 96.26 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 386.05072 |
| Heavy Atoms | 26 |
| Complexity | 936.3409 |
Chemical Identifiers
| CAS Number | 695205-72-2 |
|---|---|
| SMILES | CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NC(=S)NNC(=O)C3=CC=CS3 |
Product Overview
A3530/0149530 (CAS 695205-72-2), with molecular formula C17H14N4O3S2 and molecular weight 386.05 g/mol. IUPAC: 5-methyl-3-phenyl-N-[(thiophene-2-carbonylamino)carbamothioyl]-1,2-oxazole-4-carboxamide.
Chemical Property Profile of A3530/0149530
Property Insights of A3530/0149530
The XLogP value of 2.66082 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A3530/0149530. The TPSA of 96.26 Ų falls within the moderate polarity range, balancing permeability and solubility for A3530/0149530. Following Lipinski's Rule of Five, A3530/0149530 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 A3530/0149530?
The CAS number of A3530/0149530 is 695205-72-2.
What is the molecular formula of A3530/0149530?
The molecular formula of A3530/0149530 is C17H14N4O3S2.
What is the molecular weight of A3530/0149530?
The molecular weight of A3530/0149530 is 386.05 g/mol.
Where can I buy A3530/0149530?
You can request a quote for A3530/0149530 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3530/0149530?
Yes, KEHONG BIO provides custom synthesis services for A3530/0149530 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.