N-benzoyl-N'-(1-methyl-1H-indazol-5-yl)thiourea
TL;DR: N-benzoyl-N'-(1-methyl-1H-indazol-5-yl)thiourea (CAS 860649-96-3) is a chemical compound with molecular formula C16H14N4OS and molecular weight 310.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(1-methylindazol-5-yl)carbamothioyl]benzamide
Also Known As: N-benzoyl-N'-(1-methyl-1H-indazol-5-yl)thiourea, 1-benzoyl-3-(1-methyl-1H-indazol-5-yl)thiourea, N-[(1-methylindazol-5-yl)carbamothioyl]benzamide
| Molecular Formula | C16H14N4OS |
|---|---|
| Molecular Weight | 310.09 g/mol |
| LogP | 2.7001 |
| Topological Polar Surface Area | 58.95 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 310.08884 |
| Heavy Atoms | 22 |
| Complexity | 841.7329 |
Chemical Identifiers
| CAS Number | 860649-96-3 |
|---|---|
| SMILES | CN1C2=C(C=C(C=C2)NC(=S)NC(=O)C3=CC=CC=C3)C=N1 |
Product Overview
N-benzoyl-N'-(1-methyl-1H-indazol-5-yl)thiourea (CAS 860649-96-3), with molecular formula C16H14N4OS and molecular weight 310.09 g/mol. IUPAC: N-[(1-methylindazol-5-yl)carbamothioyl]benzamide.
Chemical Property Profile of N-benzoyl-N'-(1-methyl-1H-indazol-5-yl)thiourea
Property Insights of N-benzoyl-N'-(1-methyl-1H-indazol-5-yl)thiourea
The XLogP value of 2.7001 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-benzoyl-N'-(1-methyl-1H-indazol-5-yl)thiourea. With a topological polar surface area (TPSA) of 58.95 Ų, N-benzoyl-N'-(1-methyl-1H-indazol-5-yl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-benzoyl-N'-(1-methyl-1H-indazol-5-yl)thiourea has 2 hydrogen bond donor(s) and 3 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 N-benzoyl-N'-(1-methyl-1H-indazol-5-yl)thiourea?
The CAS number of N-benzoyl-N'-(1-methyl-1H-indazol-5-yl)thiourea is 860649-96-3.
What is the molecular formula of N-benzoyl-N'-(1-methyl-1H-indazol-5-yl)thiourea?
The molecular formula of N-benzoyl-N'-(1-methyl-1H-indazol-5-yl)thiourea is C16H14N4OS.
What is the molecular weight of N-benzoyl-N'-(1-methyl-1H-indazol-5-yl)thiourea?
The molecular weight of N-benzoyl-N'-(1-methyl-1H-indazol-5-yl)thiourea is 310.09 g/mol.
Where can I buy N-benzoyl-N'-(1-methyl-1H-indazol-5-yl)thiourea?
You can request a quote for N-benzoyl-N'-(1-methyl-1H-indazol-5-yl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-benzoyl-N'-(1-methyl-1H-indazol-5-yl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for N-benzoyl-N'-(1-methyl-1H-indazol-5-yl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.