3-chloro-N-(morpholin-4-yl)-1-benzothiophene-2-carboxamide
TL;DR: 3-chloro-N-(morpholin-4-yl)-1-benzothiophene-2-carboxamide (CAS 331255-49-3) is a chemical compound with molecular formula C13H13ClN2O2S and molecular weight 296.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-morpholin-4-yl-1-benzothiophene-2-carboxamide
Also Known As: BIM-0022357.P001, 3-chloro-N-(morpholin-4-yl)-1-benzothiophene-2-carboxamide, 3-chloro-N-morpholin-4-yl-1-benzothiophene-2-carboxamide, (3-chlorobenzo[b]thiophen-2-yl)-N-morpholin-4-ylcarboxamide
| Molecular Formula | C13H13ClN2O2S |
|---|---|
| Molecular Weight | 296.04 g/mol |
| LogP | 2.5317 |
| Topological Polar Surface Area | 41.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 296.03864 |
| Heavy Atoms | 19 |
| Complexity | 607.70905 |
Chemical Identifiers
| CAS Number | 331255-49-3 |
|---|---|
| SMILES | C1COCCN1NC(=O)C2=C(C3=CC=CC=C3S2)Cl |
Product Overview
3-chloro-N-(morpholin-4-yl)-1-benzothiophene-2-carboxamide (CAS 331255-49-3), with molecular formula C13H13ClN2O2S and molecular weight 296.04 g/mol. IUPAC: 3-chloro-N-morpholin-4-yl-1-benzothiophene-2-carboxamide.
Chemical Property Profile of 3-chloro-N-(morpholin-4-yl)-1-benzothiophene-2-carboxamide
Property Insights of 3-chloro-N-(morpholin-4-yl)-1-benzothiophene-2-carboxamide
The XLogP value of 2.5317 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-chloro-N-(morpholin-4-yl)-1-benzothiophene-2-carboxamide. With a topological polar surface area (TPSA) of 41.57 Ų, 3-chloro-N-(morpholin-4-yl)-1-benzothiophene-2-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-chloro-N-(morpholin-4-yl)-1-benzothiophene-2-carboxamide has 1 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 3-chloro-N-(morpholin-4-yl)-1-benzothiophene-2-carboxamide?
The CAS number of 3-chloro-N-(morpholin-4-yl)-1-benzothiophene-2-carboxamide is 331255-49-3.
What is the molecular formula of 3-chloro-N-(morpholin-4-yl)-1-benzothiophene-2-carboxamide?
The molecular formula of 3-chloro-N-(morpholin-4-yl)-1-benzothiophene-2-carboxamide is C13H13ClN2O2S.
What is the molecular weight of 3-chloro-N-(morpholin-4-yl)-1-benzothiophene-2-carboxamide?
The molecular weight of 3-chloro-N-(morpholin-4-yl)-1-benzothiophene-2-carboxamide is 296.04 g/mol.
Where can I buy 3-chloro-N-(morpholin-4-yl)-1-benzothiophene-2-carboxamide?
You can request a quote for 3-chloro-N-(morpholin-4-yl)-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 3-chloro-N-(morpholin-4-yl)-1-benzothiophene-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 3-chloro-N-(morpholin-4-yl)-1-benzothiophene-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.