RefChem:349865
TL;DR: RefChem:349865 (CAS 19007-33-1) is a chemical compound with molecular formula C19H21ClN2 and molecular weight 312.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-5,10-dimethyl-7,9,10,14b-tetrahydro-6H-isoquinolino[2,1-d][1,4]benzodiazepine
Also Known As: 2-Chloro-5,10-dimethyl-6,7,9,10-tetrahydro-5H-isoquino(2,1-d)(1,4)benzodiazepine, Isoquino(2,1-d)(1,4)benzodiazepine, 5,6,7,9,10,14b-hexahydro-2-chloro-5,10-dimethyl-, 2-chloro-5,10-dimethyl-7,9,10,14b-tetrahydro-6H-isoquinolino[2,1-d][1,4]benzodiazepine, 2-Chloro-5,6,7,9,10,14b-hexahydro-5,10-dimethylisoquino[2,1-d][1,4]benzodiazepine, 2-Chloro-5,10-dimethyl-5,6,7,9,10,14b-hexahydroisoquinolino[2,1-d][1,4]benzodiazepine
| Molecular Formula | C19H21ClN2 |
|---|---|
| Molecular Weight | 312.14 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 6.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 312.1393 |
| Heavy Atoms | 22 |
| Complexity | 401.0 |
Chemical Identifiers
| CAS Number | 19007-33-1 |
|---|---|
| SMILES | CC1CN2CCN(C3=C(C2C4=CC=CC=C14)C=C(C=C3)Cl)C |
| InChIKey | KXMDXMHGFNNKDP-UHFFFAOYSA-N |
Product Overview
RefChem:349865 (CAS 19007-33-1), with molecular formula C19H21ClN2 and molecular weight 312.14 g/mol. IUPAC: 2-chloro-5,10-dimethyl-7,9,10,14b-tetrahydro-6H-isoquinolino[2,1-d][1,4]benzodiazepine.
Chemical Property Profile of RefChem:349865
Property Insights of RefChem:349865
The XLogP value of 4.3 indicates that RefChem:349865 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 6.5 Ų, RefChem:349865 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:349865 has 0 hydrogen bond donor(s) and 2 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:349865?
The CAS number of RefChem:349865 is 19007-33-1.
What is the molecular formula of RefChem:349865?
The molecular formula of RefChem:349865 is C19H21ClN2.
What is the molecular weight of RefChem:349865?
The molecular weight of RefChem:349865 is 312.14 g/mol.
Where can I buy RefChem:349865?
You can request a quote for RefChem:349865 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:349865?
Yes, KEHONG BIO provides custom synthesis services for RefChem:349865 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.