![N-[[(3-bromo-4-methylbenzoyl)amino]carbamothioyl]pentanamide structure](/static/products/7178/717896-41-8.webp)
N-[[(3-bromo-4-methylbenzoyl)amino]carbamothioyl]pentanamide
TL;DR: N-[[(3-bromo-4-methylbenzoyl)amino]carbamothioyl]pentanamide (CAS 717896-41-8) is a chemical compound with molecular formula C14H18BrN3O2S and molecular weight 371.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[(3-bromo-4-methylbenzoyl)amino]carbamothioyl]pentanamide
Also Known As: N-[[(3-bromo-4-methylbenzoyl)amino]carbamothioyl]pentanamide, N-{[2-(3-bromo-4-methylbenzoyl)hydrazino]carbonothioyl}pentanamide, N-({2-[(3-bromo-4-methylphenyl)carbonyl]hydrazinyl}carbonothioyl)pentanamide
| Molecular Formula | C14H18BrN3O2S |
|---|---|
| Molecular Weight | 371.03 g/mol |
| LogP | 2.58322 |
| Topological Polar Surface Area | 70.23 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 371.0303 |
| Heavy Atoms | 21 |
| Complexity | 549.0207 |
Chemical Identifiers
| CAS Number | 717896-41-8 |
|---|---|
| SMILES | CCCCC(=O)NC(=S)NNC(=O)C1=CC(=C(C=C1)C)Br |
Product Overview
N-[[(3-bromo-4-methylbenzoyl)amino]carbamothioyl]pentanamide (CAS 717896-41-8), with molecular formula C14H18BrN3O2S and molecular weight 371.03 g/mol. IUPAC: N-[[(3-bromo-4-methylbenzoyl)amino]carbamothioyl]pentanamide.
Chemical Property Profile of N-[[(3-bromo-4-methylbenzoyl)amino]carbamothioyl]pentanamide
Property Insights of N-[[(3-bromo-4-methylbenzoyl)amino]carbamothioyl]pentanamide
The XLogP value of 2.58322 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[[(3-bromo-4-methylbenzoyl)amino]carbamothioyl]pentanamide. The TPSA of 70.23 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[[(3-bromo-4-methylbenzoyl)amino]carbamothioyl]pentanamide. Following Lipinski's Rule of Five, N-[[(3-bromo-4-methylbenzoyl)amino]carbamothioyl]pentanamide has 3 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-[[(3-bromo-4-methylbenzoyl)amino]carbamothioyl]pentanamide?
The CAS number of N-[[(3-bromo-4-methylbenzoyl)amino]carbamothioyl]pentanamide is 717896-41-8.
What is the molecular formula of N-[[(3-bromo-4-methylbenzoyl)amino]carbamothioyl]pentanamide?
The molecular formula of N-[[(3-bromo-4-methylbenzoyl)amino]carbamothioyl]pentanamide is C14H18BrN3O2S.
What is the molecular weight of N-[[(3-bromo-4-methylbenzoyl)amino]carbamothioyl]pentanamide?
The molecular weight of N-[[(3-bromo-4-methylbenzoyl)amino]carbamothioyl]pentanamide is 371.03 g/mol.
Where can I buy N-[[(3-bromo-4-methylbenzoyl)amino]carbamothioyl]pentanamide?
You can request a quote for N-[[(3-bromo-4-methylbenzoyl)amino]carbamothioyl]pentanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[[(3-bromo-4-methylbenzoyl)amino]carbamothioyl]pentanamide?
Yes, KEHONG BIO provides custom synthesis services for N-[[(3-bromo-4-methylbenzoyl)amino]carbamothioyl]pentanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.