1H-Imidazo(1,2-a)(1,4)benzodiazepin-1-one, 2,4-dihydro-8-chloro-6-phenyl-2-(1-piperazinylmethylene)-
TL;DR: 1H-Imidazo(1,2-a)(1,4)benzodiazepin-1-one, 2,4-dihydro-8-chloro-6-phenyl-2-(1-piperazinylmethylene)- (CAS 61197-57-7) is a chemical compound with molecular formula C22H20ClN5O and molecular weight 405.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E)-8-chloro-6-phenyl-2-(piperazin-1-ylmethylidene)-4H-imidazo[1,2-a][1,4]benzodiazepin-1-one
Also Known As: 1H-Imidazo(1,2-a)(1,4)benzodiazepin-1-one, 2,4-dihydro-8-chloro-6-phenyl-2-(1-piperazinylmethylene)-, (2E)-8-chloro-6-phenyl-2-(piperazin-1-ylmethylidene)-4H-imidazo[1,2-a][1,4]benzodiazepin-1-one, RefChem:1057898, BRN 0632067
| Molecular Formula | C22H20ClN5O |
|---|---|
| Molecular Weight | 405.14 g/mol |
| LogP | 2.6827 |
| Topological Polar Surface Area | 60.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 405.13565 |
| Heavy Atoms | 29 |
| Complexity | 1054.1272 |
Chemical Identifiers
| CAS Number | 61197-57-7 |
|---|---|
| SMILES | C1CN(CCN1)/C=C/2\C(=O)N3C(=N2)CN=C(C4=C3C=CC(=C4)Cl)C5=CC=CC=C5 |
Product Overview
1H-Imidazo(1,2-a)(1,4)benzodiazepin-1-one, 2,4-dihydro-8-chloro-6-phenyl-2-(1-piperazinylmethylene)- (CAS 61197-57-7), with molecular formula C22H20ClN5O and molecular weight 405.14 g/mol. IUPAC: (2E)-8-chloro-6-phenyl-2-(piperazin-1-ylmethylidene)-4H-imidazo[1,2-a][1,4]benzodiazepin-1-one.
Chemical Property Profile of 1H-Imidazo(1,2-a)(1,4)benzodiazepin-1-one, 2,4-dihydro-8-chloro-6-phenyl-2-(1-piperazinylmethylene)-
Property Insights of 1H-Imidazo(1,2-a)(1,4)benzodiazepin-1-one, 2,4-dihydro-8-chloro-6-phenyl-2-(1-piperazinylmethylene)-
The XLogP value of 2.6827 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Imidazo(1,2-a)(1,4)benzodiazepin-1-one, 2,4-dihydro-8-chloro-6-phenyl-2-(1-piperazinylmethylene)-. The TPSA of 60.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Imidazo(1,2-a)(1,4)benzodiazepin-1-one, 2,4-dihydro-8-chloro-6-phenyl-2-(1-piperazinylmethylene)-. Following Lipinski's Rule of Five, 1H-Imidazo(1,2-a)(1,4)benzodiazepin-1-one, 2,4-dihydro-8-chloro-6-phenyl-2-(1-piperazinylmethylene)- 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 1H-Imidazo(1,2-a)(1,4)benzodiazepin-1-one, 2,4-dihydro-8-chloro-6-phenyl-2-(1-piperazinylmethylene)-?
The CAS number of 1H-Imidazo(1,2-a)(1,4)benzodiazepin-1-one, 2,4-dihydro-8-chloro-6-phenyl-2-(1-piperazinylmethylene)- is 61197-57-7.
What is the molecular formula of 1H-Imidazo(1,2-a)(1,4)benzodiazepin-1-one, 2,4-dihydro-8-chloro-6-phenyl-2-(1-piperazinylmethylene)-?
The molecular formula of 1H-Imidazo(1,2-a)(1,4)benzodiazepin-1-one, 2,4-dihydro-8-chloro-6-phenyl-2-(1-piperazinylmethylene)- is C22H20ClN5O.
What is the molecular weight of 1H-Imidazo(1,2-a)(1,4)benzodiazepin-1-one, 2,4-dihydro-8-chloro-6-phenyl-2-(1-piperazinylmethylene)-?
The molecular weight of 1H-Imidazo(1,2-a)(1,4)benzodiazepin-1-one, 2,4-dihydro-8-chloro-6-phenyl-2-(1-piperazinylmethylene)- is 405.14 g/mol.
Where can I buy 1H-Imidazo(1,2-a)(1,4)benzodiazepin-1-one, 2,4-dihydro-8-chloro-6-phenyl-2-(1-piperazinylmethylene)-?
You can request a quote for 1H-Imidazo(1,2-a)(1,4)benzodiazepin-1-one, 2,4-dihydro-8-chloro-6-phenyl-2-(1-piperazinylmethylene)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Imidazo(1,2-a)(1,4)benzodiazepin-1-one, 2,4-dihydro-8-chloro-6-phenyl-2-(1-piperazinylmethylene)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Imidazo(1,2-a)(1,4)benzodiazepin-1-one, 2,4-dihydro-8-chloro-6-phenyl-2-(1-piperazinylmethylene)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.