A3530/0149534
TL;DR: A3530/0149534 (CAS 879462-60-9) is a chemical compound with molecular formula C20H16N6O4S and molecular weight 436.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[[5-(furan-2-yl)-1H-pyrazole-3-carbonyl]amino]carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
Also Known As: A3530/0149534, N-(2-(5-(furan-2-yl)-1H-pyrazole-3-carbonyl)hydrazinecarbonothioyl)-5-methyl-3-phenylisoxazole-4-carboxamide, N-[(2-{[5-(furan-2-yl)-1H-pyrazol-3-yl]carbonyl}hydrazinyl)carbonothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide, N-[[[5-(furan-2-yl)-1H-pyrazole-3-carbonyl]amino]carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide, N~4~-[(2-{[5-(2-FURYL)-1H-PYRAZOL-3-YL]CARBONYL}HYDRAZINO)CARBOTHIOYL]-5-METHYL-3-PHENYL-4-ISOXAZOLECARBOXAMIDE
| Molecular Formula | C20H16N6O4S |
|---|---|
| Molecular Weight | 436.10 g/mol |
| LogP | 2.58242 |
| Topological Polar Surface Area | 138.08 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 436.09537 |
| Heavy Atoms | 31 |
| Complexity | 1229.856 |
Chemical Identifiers
| CAS Number | 879462-60-9 |
|---|---|
| SMILES | CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NC(=S)NNC(=O)C3=NNC(=C3)C4=CC=CO4 |
Product Overview
A3530/0149534 (CAS 879462-60-9), with molecular formula C20H16N6O4S and molecular weight 436.10 g/mol. IUPAC: N-[[[5-(furan-2-yl)-1H-pyrazole-3-carbonyl]amino]carbamothioyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide.
Chemical Property Profile of A3530/0149534
Property Insights of A3530/0149534
The XLogP value of 2.58242 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A3530/0149534. The TPSA of 138.08 Ų falls within the moderate polarity range, balancing permeability and solubility for A3530/0149534. Following Lipinski's Rule of Five, A3530/0149534 has 4 hydrogen bond donor(s) and 7 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 A3530/0149534?
The CAS number of A3530/0149534 is 879462-60-9.
What is the molecular formula of A3530/0149534?
The molecular formula of A3530/0149534 is C20H16N6O4S.
What is the molecular weight of A3530/0149534?
The molecular weight of A3530/0149534 is 436.10 g/mol.
Where can I buy A3530/0149534?
You can request a quote for A3530/0149534 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3530/0149534?
Yes, KEHONG BIO provides custom synthesis services for A3530/0149534 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.