N-(1,3-benzothiazol-2-yl)-3-chloropropanamide
TL;DR: N-(1,3-benzothiazol-2-yl)-3-chloropropanamide (CAS 2877-36-3) is a chemical compound with molecular formula C10H9ClN2OS and molecular weight 240.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzothiazol-2-yl)-3-chloropropanamide
Also Known As: N-1,3-BENZOTHIAZOL-2-YL-3-CHLOROPROPANAMIDE, N-(1,3-benzothiazol-2-yl)-3-chloropropanamide, Propanamide, N-2-benzothiazolyl-3-chloro-, N-(Benzo[d]thiazol-2-yl)-3-chloropropanamide, N-Benzothiazol-2-yl-3-chloro-propionamide
| Molecular Formula | C10H9ClN2OS |
|---|---|
| Molecular Weight | 240.01 g/mol |
| LogP | 2.8637 |
| Topological Polar Surface Area | 41.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 240.0124 |
| Heavy Atoms | 15 |
| Complexity | 449.98206 |
Chemical Identifiers
| CAS Number | 2877-36-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)NC(=O)CCCl |
Product Overview
N-(1,3-benzothiazol-2-yl)-3-chloropropanamide (CAS 2877-36-3), with molecular formula C10H9ClN2OS and molecular weight 240.01 g/mol. IUPAC: N-(1,3-benzothiazol-2-yl)-3-chloropropanamide.
Chemical Property Profile of N-(1,3-benzothiazol-2-yl)-3-chloropropanamide
Property Insights of N-(1,3-benzothiazol-2-yl)-3-chloropropanamide
The XLogP value of 2.8637 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,3-benzothiazol-2-yl)-3-chloropropanamide. With a topological polar surface area (TPSA) of 41.99 Ų, N-(1,3-benzothiazol-2-yl)-3-chloropropanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1,3-benzothiazol-2-yl)-3-chloropropanamide has 1 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-(1,3-benzothiazol-2-yl)-3-chloropropanamide?
The CAS number of N-(1,3-benzothiazol-2-yl)-3-chloropropanamide is 2877-36-3.
What is the molecular formula of N-(1,3-benzothiazol-2-yl)-3-chloropropanamide?
The molecular formula of N-(1,3-benzothiazol-2-yl)-3-chloropropanamide is C10H9ClN2OS.
What is the molecular weight of N-(1,3-benzothiazol-2-yl)-3-chloropropanamide?
The molecular weight of N-(1,3-benzothiazol-2-yl)-3-chloropropanamide is 240.01 g/mol.
Where can I buy N-(1,3-benzothiazol-2-yl)-3-chloropropanamide?
You can request a quote for N-(1,3-benzothiazol-2-yl)-3-chloropropanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,3-benzothiazol-2-yl)-3-chloropropanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzothiazol-2-yl)-3-chloropropanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.