7CL-1,3H2-1-Clet-3-eto-5PH-1,4-benzodiazepin-2-O
TL;DR: 7CL-1,3H2-1-Clet-3-eto-5PH-1,4-benzodiazepin-2-O (CAS 56875-86-6) is a chemical compound with molecular formula C19H18Cl2N2O2 and molecular weight 376.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-chloro-1-(2-chloroethyl)-3-ethoxy-5-phenyl-3H-1,4-benzodiazepin-2-one
Also Known As: 7CL-1,3H2-1-CLET-3-ETO-5PH-1,4-BENZODIAZEPIN-2-O, 7-chloro-1-(2-chloroethyl)-3-ethoxy-5-phenyl-3H-1,4-benzodiazepin-2-one, 7-Chloro-1-(2-chloroethyl)-3-ethoxy-5-phenyl-1,3-dihydro-2H-1,4-benzodiazepin-2-one, 9-chloro-2-(2-chloroethyl)-4-ethoxy-6-phenyl-2,5-diazabicyclo[5.4.0]undeca-5,8,10,12-tetraen-3-one
| Molecular Formula | C19H18Cl2N2O2 |
|---|---|
| Molecular Weight | 376.07 g/mol |
| LogP | 4.1254 |
| Topological Polar Surface Area | 41.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 376.07452 |
| Heavy Atoms | 25 |
| Complexity | 793.26605 |
Chemical Identifiers
| CAS Number | 56875-86-6 |
|---|---|
| SMILES | CCOC1C(=O)N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3)CCCl |
Product Overview
7CL-1,3H2-1-Clet-3-eto-5PH-1,4-benzodiazepin-2-O (CAS 56875-86-6), with molecular formula C19H18Cl2N2O2 and molecular weight 376.07 g/mol. IUPAC: 7-chloro-1-(2-chloroethyl)-3-ethoxy-5-phenyl-3H-1,4-benzodiazepin-2-one.
Chemical Property Profile of 7CL-1,3H2-1-Clet-3-eto-5PH-1,4-benzodiazepin-2-O
Property Insights of 7CL-1,3H2-1-Clet-3-eto-5PH-1,4-benzodiazepin-2-O
The XLogP value of 4.1254 indicates that 7CL-1,3H2-1-Clet-3-eto-5PH-1,4-benzodiazepin-2-O is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.9 Ų, 7CL-1,3H2-1-Clet-3-eto-5PH-1,4-benzodiazepin-2-O exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7CL-1,3H2-1-Clet-3-eto-5PH-1,4-benzodiazepin-2-O 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 7CL-1,3H2-1-Clet-3-eto-5PH-1,4-benzodiazepin-2-O?
The CAS number of 7CL-1,3H2-1-Clet-3-eto-5PH-1,4-benzodiazepin-2-O is 56875-86-6.
What is the molecular formula of 7CL-1,3H2-1-Clet-3-eto-5PH-1,4-benzodiazepin-2-O?
The molecular formula of 7CL-1,3H2-1-Clet-3-eto-5PH-1,4-benzodiazepin-2-O is C19H18Cl2N2O2.
What is the molecular weight of 7CL-1,3H2-1-Clet-3-eto-5PH-1,4-benzodiazepin-2-O?
The molecular weight of 7CL-1,3H2-1-Clet-3-eto-5PH-1,4-benzodiazepin-2-O is 376.07 g/mol.
Where can I buy 7CL-1,3H2-1-Clet-3-eto-5PH-1,4-benzodiazepin-2-O?
You can request a quote for 7CL-1,3H2-1-Clet-3-eto-5PH-1,4-benzodiazepin-2-O directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7CL-1,3H2-1-Clet-3-eto-5PH-1,4-benzodiazepin-2-O?
Yes, KEHONG BIO provides custom synthesis services for 7CL-1,3H2-1-Clet-3-eto-5PH-1,4-benzodiazepin-2-O and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.