C17H20ClN3
TL;DR: C17H20ClN3 (CAS 2244-74-8) is a chemical compound with molecular formula C17H20ClN3 and molecular weight 301.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-chloro-6,11-dihydrobenzo[b][1,4]benzodiazepin-5-yl)-N,N-dimethylethanamine
Also Known As: 5-23-08-00274 (Beilstein Handbook Reference), 5H-Dibenzo(b,e)(1,4)diazepine, 10,11-dihydro-7-chloro-10-(2-(dimethylamino)ethyl)-, 10,11-Dihydro-(5H)-dibenzo(b,e)(1,4)diazepine, 7-chloro-10-(2-(dimethylamino)ethyl)-, 7-Chlor-10-beta-dimethylamino-aethyl-10,11-dihydro-5H-dibenzo-(b,e)(1,4)-diazepin [German], 7-Chlor-10-beta-dimethylamino-aethyl-10,11-dihydro-5H-dibenzo-(b,e)(1,4)-diazepin
| Molecular Formula | C17H20ClN3 |
|---|---|
| Molecular Weight | 301.13 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 301.13458 |
| Heavy Atoms | 21 |
| Complexity | 336.0 |
Chemical Identifiers
| CAS Number | 2244-74-8 |
|---|---|
| SMILES | CN(C)CCN1CC2=CC=CC=C2NC3=C1C=CC(=C3)Cl |
| InChIKey | JABRUTZIAKYXPW-UHFFFAOYSA-N |
Product Overview
C17H20ClN3 (CAS 2244-74-8), with molecular formula C17H20ClN3 and molecular weight 301.13 g/mol. IUPAC: 2-(2-chloro-6,11-dihydrobenzo[b][1,4]benzodiazepin-5-yl)-N,N-dimethylethanamine.
Chemical Property Profile of C17H20ClN3
Property Insights of C17H20ClN3
The XLogP value of 3.8 indicates that C17H20ClN3 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, C17H20ClN3 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C17H20ClN3 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 C17H20ClN3?
The CAS number of C17H20ClN3 is 2244-74-8.
What is the molecular formula of C17H20ClN3?
The molecular formula of C17H20ClN3 is C17H20ClN3.
What is the molecular weight of C17H20ClN3?
The molecular weight of C17H20ClN3 is 301.13 g/mol.
Where can I buy C17H20ClN3?
You can request a quote for C17H20ClN3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C17H20ClN3?
Yes, KEHONG BIO provides custom synthesis services for C17H20ClN3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.