Cambridge id 5586032
TL;DR: Cambridge id 5586032 (CAS 301321-80-2) is a chemical compound with molecular formula C21H23ClN2O2S and molecular weight 402.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-[3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]benzamide
Also Known As: BAS 01022640, 2-chloro-N-[3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]benzamide, 2-chloro-N-[3-(1-piperidinylcarbonyl)-4,5,6,7-tetrahydro-1-benzothien-2-yl]benzamide, 2-chloro-N-[3-(piperidin-1-ylcarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]benzamide, 2-CHLORO-N~1~-[3-(PIPERIDINOCARBONYL)-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHEN-2-YL]BENZAMIDE
| Molecular Formula | C21H23ClN2O2S |
|---|---|
| Molecular Weight | 402.12 g/mol |
| LogP | 5.1587 |
| Topological Polar Surface Area | 49.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 402.11688 |
| Heavy Atoms | 27 |
| Complexity | 871.0617 |
Chemical Identifiers
| CAS Number | 301321-80-2 |
|---|---|
| SMILES | C1CCN(CC1)C(=O)C2=C(SC3=C2CCCC3)NC(=O)C4=CC=CC=C4Cl |
Product Overview
Cambridge id 5586032 (CAS 301321-80-2), with molecular formula C21H23ClN2O2S and molecular weight 402.12 g/mol. IUPAC: 2-chloro-N-[3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]benzamide.
Chemical Property Profile of Cambridge id 5586032
Property Insights of Cambridge id 5586032
The XLogP value of 5.1587 indicates that Cambridge id 5586032 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.41 Ų, Cambridge id 5586032 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cambridge id 5586032 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cambridge id 5586032?
The CAS number of Cambridge id 5586032 is 301321-80-2.
What is the molecular formula of Cambridge id 5586032?
The molecular formula of Cambridge id 5586032 is C21H23ClN2O2S.
What is the molecular weight of Cambridge id 5586032?
The molecular weight of Cambridge id 5586032 is 402.12 g/mol.
Where can I buy Cambridge id 5586032?
You can request a quote for Cambridge id 5586032 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cambridge id 5586032?
Yes, KEHONG BIO provides custom synthesis services for Cambridge id 5586032 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.