Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-(2-chlorophenyl)-6-methyl-
TL;DR: Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-(2-chlorophenyl)-6-methyl- (CAS 57435-89-9) is a chemical compound with molecular formula C14H12ClN3O and molecular weight 273.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2-chlorophenyl)-6-methyl-3,7-dihydro-1H-pyrrolo[3,4-e][1,4]diazepin-2-one
Also Known As: Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-(2-chlorophenyl)-6-methyl-, 3,7-Dihydro-5-(2-chlorophenyl)-6-methylpyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 5-(2-chlorophenyl)-6-methyl-3,7-dihydro-1H-pyrrolo[3,4-e][1,4]diazepin-2-one, 5-(2-Chlorophenyl)-6-methyl-3,7-dihydropyrrolo[3,4-e][1,4]diazepin-2(1H)-one, BRN 0620124
| Molecular Formula | C14H12ClN3O |
|---|---|
| Molecular Weight | 273.07 g/mol |
| LogP | 2.76602 |
| Topological Polar Surface Area | 57.25 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 273.0669 |
| Heavy Atoms | 19 |
| Complexity | 687.7496 |
Chemical Identifiers
| CAS Number | 57435-89-9 |
|---|---|
| SMILES | CC1=C2C(=CN1)NC(=O)CN=C2C3=CC=CC=C3Cl |
Product Overview
Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-(2-chlorophenyl)-6-methyl- (CAS 57435-89-9), with molecular formula C14H12ClN3O and molecular weight 273.07 g/mol. IUPAC: 5-(2-chlorophenyl)-6-methyl-3,7-dihydro-1H-pyrrolo[3,4-e][1,4]diazepin-2-one.
Chemical Property Profile of Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-(2-chlorophenyl)-6-methyl-
Property Insights of Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-(2-chlorophenyl)-6-methyl-
The XLogP value of 2.76602 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-(2-chlorophenyl)-6-methyl-. With a topological polar surface area (TPSA) of 57.25 Ų, Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-(2-chlorophenyl)-6-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-(2-chlorophenyl)-6-methyl- has 2 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 Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-(2-chlorophenyl)-6-methyl-?
The CAS number of Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-(2-chlorophenyl)-6-methyl- is 57435-89-9.
What is the molecular formula of Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-(2-chlorophenyl)-6-methyl-?
The molecular formula of Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-(2-chlorophenyl)-6-methyl- is C14H12ClN3O.
What is the molecular weight of Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-(2-chlorophenyl)-6-methyl-?
The molecular weight of Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-(2-chlorophenyl)-6-methyl- is 273.07 g/mol.
Where can I buy Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-(2-chlorophenyl)-6-methyl-?
You can request a quote for Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-(2-chlorophenyl)-6-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-(2-chlorophenyl)-6-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-(2-chlorophenyl)-6-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.