![N-[4-(acetylcarbamothioylamino)phenyl]-3-chloro-1-benzothiophene-2-carboxamide structure](/static/products/6402/640249-48-5.webp)
N-[4-(acetylcarbamothioylamino)phenyl]-3-chloro-1-benzothiophene-2-carboxamide
TL;DR: N-[4-(acetylcarbamothioylamino)phenyl]-3-chloro-1-benzothiophene-2-carboxamide (CAS 640249-48-5) is a chemical compound with molecular formula C18H14ClN3O2S2 and molecular weight 403.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(acetylcarbamothioylamino)phenyl]-3-chloro-1-benzothiophene-2-carboxamide
Also Known As: N-(4-(3-acetylthioureido)phenyl)-3-chlorobenzo[b]thiophene-2-carboxamide, N-[4-(acetylcarbamothioylamino)phenyl]-3-chloro-1-benzothiophene-2-carboxamide, N-{4-[(acetylcarbamothioyl)amino]phenyl}-3-chloro-1-benzothiophene-2-carboxamide
| Molecular Formula | C18H14ClN3O2S2 |
|---|---|
| Molecular Weight | 403.02 g/mol |
| LogP | 4.6399 |
| Topological Polar Surface Area | 70.23 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 403.0216 |
| Heavy Atoms | 26 |
| Complexity | 999.3438 |
Chemical Identifiers
| CAS Number | 640249-48-5 |
|---|---|
| SMILES | CC(=O)NC(=S)NC1=CC=C(C=C1)NC(=O)C2=C(C3=CC=CC=C3S2)Cl |
Product Overview
N-[4-(acetylcarbamothioylamino)phenyl]-3-chloro-1-benzothiophene-2-carboxamide (CAS 640249-48-5), with molecular formula C18H14ClN3O2S2 and molecular weight 403.02 g/mol. IUPAC: N-[4-(acetylcarbamothioylamino)phenyl]-3-chloro-1-benzothiophene-2-carboxamide.
Chemical Property Profile of N-[4-(acetylcarbamothioylamino)phenyl]-3-chloro-1-benzothiophene-2-carboxamide
Property Insights of N-[4-(acetylcarbamothioylamino)phenyl]-3-chloro-1-benzothiophene-2-carboxamide
The XLogP value of 4.6399 indicates that N-[4-(acetylcarbamothioylamino)phenyl]-3-chloro-1-benzothiophene-2-carboxamide 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-[4-(acetylcarbamothioylamino)phenyl]-3-chloro-1-benzothiophene-2-carboxamide. Following Lipinski's Rule of Five, N-[4-(acetylcarbamothioylamino)phenyl]-3-chloro-1-benzothiophene-2-carboxamide 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-[4-(acetylcarbamothioylamino)phenyl]-3-chloro-1-benzothiophene-2-carboxamide?
The CAS number of N-[4-(acetylcarbamothioylamino)phenyl]-3-chloro-1-benzothiophene-2-carboxamide is 640249-48-5.
What is the molecular formula of N-[4-(acetylcarbamothioylamino)phenyl]-3-chloro-1-benzothiophene-2-carboxamide?
The molecular formula of N-[4-(acetylcarbamothioylamino)phenyl]-3-chloro-1-benzothiophene-2-carboxamide is C18H14ClN3O2S2.
What is the molecular weight of N-[4-(acetylcarbamothioylamino)phenyl]-3-chloro-1-benzothiophene-2-carboxamide?
The molecular weight of N-[4-(acetylcarbamothioylamino)phenyl]-3-chloro-1-benzothiophene-2-carboxamide is 403.02 g/mol.
Where can I buy N-[4-(acetylcarbamothioylamino)phenyl]-3-chloro-1-benzothiophene-2-carboxamide?
You can request a quote for N-[4-(acetylcarbamothioylamino)phenyl]-3-chloro-1-benzothiophene-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[4-(acetylcarbamothioylamino)phenyl]-3-chloro-1-benzothiophene-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[4-(acetylcarbamothioylamino)phenyl]-3-chloro-1-benzothiophene-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.