N-[[(3-chloro-1-benzothiophene-2-carbonyl)amino]carbamothioyl]pentanamide
TL;DR: N-[[(3-chloro-1-benzothiophene-2-carbonyl)amino]carbamothioyl]pentanamide (CAS 817558-74-0) is a chemical compound with molecular formula C15H16ClN3O2S2 and molecular weight 369.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[(3-chloro-1-benzothiophene-2-carbonyl)amino]carbamothioyl]pentanamide
Also Known As: N-[[(3-chloro-1-benzothiophene-2-carbonyl)amino]carbamothioyl]pentanamide, N-({2-[(3-chloro-1-benzothien-2-yl)carbonyl]hydrazino}carbonothioyl)pentanamide, N-({2-[(3-chloro-1-benzothiophen-2-yl)carbonyl]hydrazinyl}carbonothioyl)pentanamide
| Molecular Formula | C15H16ClN3O2S2 |
|---|---|
| Molecular Weight | 369.04 g/mol |
| LogP | 3.3804 |
| Topological Polar Surface Area | 70.23 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 369.03726 |
| Heavy Atoms | 23 |
| Complexity | 745.3973 |
Chemical Identifiers
| CAS Number | 817558-74-0 |
|---|---|
| SMILES | CCCCC(=O)NC(=S)NNC(=O)C1=C(C2=CC=CC=C2S1)Cl |
Product Overview
N-[[(3-chloro-1-benzothiophene-2-carbonyl)amino]carbamothioyl]pentanamide (CAS 817558-74-0), with molecular formula C15H16ClN3O2S2 and molecular weight 369.04 g/mol. IUPAC: N-[[(3-chloro-1-benzothiophene-2-carbonyl)amino]carbamothioyl]pentanamide.
Chemical Property Profile of N-[[(3-chloro-1-benzothiophene-2-carbonyl)amino]carbamothioyl]pentanamide
Property Insights of N-[[(3-chloro-1-benzothiophene-2-carbonyl)amino]carbamothioyl]pentanamide
The XLogP value of 3.3804 indicates that N-[[(3-chloro-1-benzothiophene-2-carbonyl)amino]carbamothioyl]pentanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.23 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[[(3-chloro-1-benzothiophene-2-carbonyl)amino]carbamothioyl]pentanamide. Following Lipinski's Rule of Five, N-[[(3-chloro-1-benzothiophene-2-carbonyl)amino]carbamothioyl]pentanamide has 3 hydrogen bond donor(s) and 4 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-chloro-1-benzothiophene-2-carbonyl)amino]carbamothioyl]pentanamide?
The CAS number of N-[[(3-chloro-1-benzothiophene-2-carbonyl)amino]carbamothioyl]pentanamide is 817558-74-0.
What is the molecular formula of N-[[(3-chloro-1-benzothiophene-2-carbonyl)amino]carbamothioyl]pentanamide?
The molecular formula of N-[[(3-chloro-1-benzothiophene-2-carbonyl)amino]carbamothioyl]pentanamide is C15H16ClN3O2S2.
What is the molecular weight of N-[[(3-chloro-1-benzothiophene-2-carbonyl)amino]carbamothioyl]pentanamide?
The molecular weight of N-[[(3-chloro-1-benzothiophene-2-carbonyl)amino]carbamothioyl]pentanamide is 369.04 g/mol.
Where can I buy N-[[(3-chloro-1-benzothiophene-2-carbonyl)amino]carbamothioyl]pentanamide?
You can request a quote for N-[[(3-chloro-1-benzothiophene-2-carbonyl)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-chloro-1-benzothiophene-2-carbonyl)amino]carbamothioyl]pentanamide?
Yes, KEHONG BIO provides custom synthesis services for N-[[(3-chloro-1-benzothiophene-2-carbonyl)amino]carbamothioyl]pentanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.