![Propyl 4-{[(3-chloro-1-benzothien-2-yl)carbonyl]amino}benzoate structure](/static/products/3496/349643-64-7.webp)
Propyl 4-{[(3-chloro-1-benzothien-2-yl)carbonyl]amino}benzoate
TL;DR: Propyl 4-{[(3-chloro-1-benzothien-2-yl)carbonyl]amino}benzoate (CAS 349643-64-7) is a chemical compound with molecular formula C19H16ClNO3S and molecular weight 373.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl 4-[(3-chloro-1-benzothiophene-2-carbonyl)amino]benzoate
Also Known As: propyl 4-{[(3-chloro-1-benzothien-2-yl)carbonyl]amino}benzoate, AN-329/12974336, propyl 4-[(3-chloro-1-benzothiophene-2-carbonyl)amino]benzoate, propyl 4-(3-chlorobenzo[b]thiophene-2-carboxamido)benzoate, propyl 4-[(3-chlorobenzo[b]thiophen-2-yl)carbonylamino]benzoate
| Molecular Formula | C19H16ClNO3S |
|---|---|
| Molecular Weight | 373.05 g/mol |
| LogP | 5.3738 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 373.05396 |
| Heavy Atoms | 25 |
| Complexity | 918.06885 |
Chemical Identifiers
| CAS Number | 349643-64-7 |
|---|---|
| SMILES | CCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C3=CC=CC=C3S2)Cl |
Product Overview
Propyl 4-{[(3-chloro-1-benzothien-2-yl)carbonyl]amino}benzoate (CAS 349643-64-7), with molecular formula C19H16ClNO3S and molecular weight 373.05 g/mol. IUPAC: propyl 4-[(3-chloro-1-benzothiophene-2-carbonyl)amino]benzoate.
Chemical Property Profile of Propyl 4-{[(3-chloro-1-benzothien-2-yl)carbonyl]amino}benzoate
Property Insights of Propyl 4-{[(3-chloro-1-benzothien-2-yl)carbonyl]amino}benzoate
The XLogP value of 5.3738 indicates that Propyl 4-{[(3-chloro-1-benzothien-2-yl)carbonyl]amino}benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, Propyl 4-{[(3-chloro-1-benzothien-2-yl)carbonyl]amino}benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propyl 4-{[(3-chloro-1-benzothien-2-yl)carbonyl]amino}benzoate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Propyl 4-{[(3-chloro-1-benzothien-2-yl)carbonyl]amino}benzoate?
The CAS number of Propyl 4-{[(3-chloro-1-benzothien-2-yl)carbonyl]amino}benzoate is 349643-64-7.
What is the molecular formula of Propyl 4-{[(3-chloro-1-benzothien-2-yl)carbonyl]amino}benzoate?
The molecular formula of Propyl 4-{[(3-chloro-1-benzothien-2-yl)carbonyl]amino}benzoate is C19H16ClNO3S.
What is the molecular weight of Propyl 4-{[(3-chloro-1-benzothien-2-yl)carbonyl]amino}benzoate?
The molecular weight of Propyl 4-{[(3-chloro-1-benzothien-2-yl)carbonyl]amino}benzoate is 373.05 g/mol.
Where can I buy Propyl 4-{[(3-chloro-1-benzothien-2-yl)carbonyl]amino}benzoate?
You can request a quote for Propyl 4-{[(3-chloro-1-benzothien-2-yl)carbonyl]amino}benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propyl 4-{[(3-chloro-1-benzothien-2-yl)carbonyl]amino}benzoate?
Yes, KEHONG BIO provides custom synthesis services for Propyl 4-{[(3-chloro-1-benzothien-2-yl)carbonyl]amino}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.