7-chloro-5-(2-chlorophenyl)-N-[(E)-1,1-dimethoxypropan-2-yli
TL;DR: 7-chloro-5-(2-chlorophenyl)-N-[(E)-1,1-dimethoxypropan-2-yli (CAS 65867-88-1) is a chemical compound with molecular formula C20H20Cl2N4O2 and molecular weight 418.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-chloro-5-(2-chlorophenyl)-N-(1,1-dimethoxypropan-2-ylideneamino)-3H-1,4-benzodiazepin-2-amine
Also Known As: 7-chloro-5-(2-chlorophenyl)-N-[(E)-1,1-dimethoxypropan-2-yli, 1,1-Dimethoxyacetone (7-chloro-5-(2-chlorophenyl)-3H-1,4-benzodiazepin-2-yl)hydrazone, 7-Chloro-5-(2-chlorophenyl)-2-[2-(1,1-dimethoxypropan-2-ylidene)hydrazin-1-yl]-3H-1,4-benzodiazepine, 7-Chloro-5-(2-chlorophenyl)-2-[2-(1,1-dimethoxypropan-2-ylidene)hydrazinyl]-3H-1,4-benzodiazepine, 7-chloro-5-(2-chlorophenyl)-N-(1,1-dimethoxypropan-2-ylideneamino)-3H-1,4-benzodiazepin-2-amine
| Molecular Formula | C20H20Cl2N4O2 |
|---|---|
| Molecular Weight | 418.10 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 67.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 418.09634 |
| Heavy Atoms | 28 |
| Complexity | 621.0 |
Chemical Identifiers
| CAS Number | 65867-88-1 |
|---|---|
| SMILES | CC(=NNC1=NC2=C(C=C(C=C2)Cl)C(=NC1)C3=CC=CC=C3Cl)C(OC)OC |
| InChIKey | WUCKKJHMSZOXLN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
7-chloro-5-(2-chlorophenyl)-N-[(E)-1,1-dimethoxypropan-2-yli (CAS 65867-88-1), with molecular formula C20H20Cl2N4O2 and molecular weight 418.10 g/mol. IUPAC: 7-chloro-5-(2-chlorophenyl)-N-(1,1-dimethoxypropan-2-ylideneamino)-3H-1,4-benzodiazepin-2-amine.
Chemical Property Profile of 7-chloro-5-(2-chlorophenyl)-N-[(E)-1,1-dimethoxypropan-2-yli
Property Insights of 7-chloro-5-(2-chlorophenyl)-N-[(E)-1,1-dimethoxypropan-2-yli
The XLogP value of 3.8 indicates that 7-chloro-5-(2-chlorophenyl)-N-[(E)-1,1-dimethoxypropan-2-yli is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-chloro-5-(2-chlorophenyl)-N-[(E)-1,1-dimethoxypropan-2-yli. Following Lipinski's Rule of Five, 7-chloro-5-(2-chlorophenyl)-N-[(E)-1,1-dimethoxypropan-2-yli has 1 hydrogen bond donor(s) and 5 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 7-chloro-5-(2-chlorophenyl)-N-[(E)-1,1-dimethoxypropan-2-yli?
The CAS number of 7-chloro-5-(2-chlorophenyl)-N-[(E)-1,1-dimethoxypropan-2-yli is 65867-88-1.
What is the molecular formula of 7-chloro-5-(2-chlorophenyl)-N-[(E)-1,1-dimethoxypropan-2-yli?
The molecular formula of 7-chloro-5-(2-chlorophenyl)-N-[(E)-1,1-dimethoxypropan-2-yli is C20H20Cl2N4O2.
What is the molecular weight of 7-chloro-5-(2-chlorophenyl)-N-[(E)-1,1-dimethoxypropan-2-yli?
The molecular weight of 7-chloro-5-(2-chlorophenyl)-N-[(E)-1,1-dimethoxypropan-2-yli is 418.10 g/mol.
Where can I buy 7-chloro-5-(2-chlorophenyl)-N-[(E)-1,1-dimethoxypropan-2-yli?
You can request a quote for 7-chloro-5-(2-chlorophenyl)-N-[(E)-1,1-dimethoxypropan-2-yli directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-chloro-5-(2-chlorophenyl)-N-[(E)-1,1-dimethoxypropan-2-yli?
Yes, KEHONG BIO provides custom synthesis services for 7-chloro-5-(2-chlorophenyl)-N-[(E)-1,1-dimethoxypropan-2-yli and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.