2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-7-chloro-3-(dimethylamino)-5-phenyl-
TL;DR: 2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-7-chloro-3-(dimethylamino)-5-phenyl- (CAS 52831-71-7) is a chemical compound with molecular formula C17H16ClN3O and molecular weight 313.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-chloro-3-(dimethylamino)-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one
Also Known As: 5-25-15-00272 (Beilstein Handbook Reference), 1,3-Dihydro-7-chloro-3-(dimethylamino)-5-phenyl-2H-1,4-benzodiazepin-2-one, 2H-1,4-BENZODIAZEPIN-2-ONE, 1,3-DIHYDRO-7-CHLORO-3-(DIMETHYLAMINO)-5-PHENYL-, 3-(Dimethylamino)-7-chloro-5-phenyl-1,3-dihydro-2H-1,4-benzodiazepin-2-one, 7-Chloro-3-(dimethylamino)-5-phenyl-1,3-dihydro-2H-1,4-benzodiazepin-2-one
| Molecular Formula | C17H16ClN3O |
|---|---|
| Molecular Weight | 313.10 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 44.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 313.09818 |
| Heavy Atoms | 22 |
| Complexity | 445.0 |
Chemical Identifiers
| CAS Number | 52831-71-7 |
|---|---|
| SMILES | CN(C)C1C(=O)NC2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3 |
| InChIKey | OFCPZQURDICMJP-UHFFFAOYSA-N |
Product Overview
2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-7-chloro-3-(dimethylamino)-5-phenyl- (CAS 52831-71-7), with molecular formula C17H16ClN3O and molecular weight 313.10 g/mol. IUPAC: 7-chloro-3-(dimethylamino)-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one.
Chemical Property Profile of 2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-7-chloro-3-(dimethylamino)-5-phenyl-
Property Insights of 2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-7-chloro-3-(dimethylamino)-5-phenyl-
The XLogP value of 3.1 indicates that 2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-7-chloro-3-(dimethylamino)-5-phenyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.7 Ų, 2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-7-chloro-3-(dimethylamino)-5-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-7-chloro-3-(dimethylamino)-5-phenyl- 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 2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-7-chloro-3-(dimethylamino)-5-phenyl-?
The CAS number of 2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-7-chloro-3-(dimethylamino)-5-phenyl- is 52831-71-7.
What is the molecular formula of 2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-7-chloro-3-(dimethylamino)-5-phenyl-?
The molecular formula of 2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-7-chloro-3-(dimethylamino)-5-phenyl- is C17H16ClN3O.
What is the molecular weight of 2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-7-chloro-3-(dimethylamino)-5-phenyl-?
The molecular weight of 2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-7-chloro-3-(dimethylamino)-5-phenyl- is 313.10 g/mol.
Where can I buy 2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-7-chloro-3-(dimethylamino)-5-phenyl-?
You can request a quote for 2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-7-chloro-3-(dimethylamino)-5-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-7-chloro-3-(dimethylamino)-5-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 2H-1,4-Benzodiazepin-2-one, 1,3-dihydro-7-chloro-3-(dimethylamino)-5-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.