RefChem:349854
TL;DR: RefChem:349854 (CAS 10256-71-0) is a chemical compound with molecular formula C22H26ClN3O and molecular weight 383.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-5-[3-(dimethylamino)propyl]-7,9,10,14b-tetrahydroisoquinolino[2,1-d][1,4]benzodiazepin-6-one
Also Known As: Isoquino(2,1-d)(1,4)benzodiazepin-6(7H)-one, 5,9,10,14b-tetrahydro-2-chloro-5-(3-(dimethylamino)propyl)-, 2-Chloro-5-[3-(dimethylamino)propyl]-5,9,10,14b-tetrahydroisoquinolino[2,1-d][1,4]benzodiazepin-6(7H)-one, 2-Chloro-5-[3-(dimethylamino)propyl]-7,9,10,14b-tetrahydroisoquino[2,1-d][1,4]benzodiazepin-6(5H)-one, 2-chloro-5-[3-(dimethylamino)propyl]-7,9,10,14b-tetrahydroisoquinolino[2,1-d][1,4]benzodiazepin-6-one, 4-chloro-8-[3-(dimethylamino)propyl]-8,11-diazatetracyclo[9.8.0.02,7.014,19]nonadeca-2,4,6,14,16,18-hexaen-9-one
| Molecular Formula | C22H26ClN3O |
|---|---|
| Molecular Weight | 383.18 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 26.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 383.17645 |
| Heavy Atoms | 27 |
| Complexity | 528.0 |
Chemical Identifiers
| CAS Number | 10256-71-0 |
|---|---|
| SMILES | CN(C)CCCN1C(=O)CN2CCC3=CC=CC=C3C2C4=C1C=CC(=C4)Cl |
| InChIKey | WRLKSRFIDCHIRT-UHFFFAOYSA-N |
Product Overview
RefChem:349854 (CAS 10256-71-0), with molecular formula C22H26ClN3O and molecular weight 383.18 g/mol. IUPAC: 2-chloro-5-[3-(dimethylamino)propyl]-7,9,10,14b-tetrahydroisoquinolino[2,1-d][1,4]benzodiazepin-6-one.
Chemical Property Profile of RefChem:349854
Property Insights of RefChem:349854
The XLogP value of 3.7 indicates that RefChem:349854 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.8 Ų, RefChem:349854 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:349854 has 0 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 RefChem:349854?
The CAS number of RefChem:349854 is 10256-71-0.
What is the molecular formula of RefChem:349854?
The molecular formula of RefChem:349854 is C22H26ClN3O.
What is the molecular weight of RefChem:349854?
The molecular weight of RefChem:349854 is 383.18 g/mol.
Where can I buy RefChem:349854?
You can request a quote for RefChem:349854 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:349854?
Yes, KEHONG BIO provides custom synthesis services for RefChem:349854 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.