Pyrrolo(3,2,1-jk)(1,4)benzodiazepine, 9-chloro-1,2,3,4,6,7-hexahydro-
TL;DR: Pyrrolo(3,2,1-jk)(1,4)benzodiazepine, 9-chloro-1,2,3,4,6,7-hexahydro- (CAS 28740-92-3) is a chemical compound with molecular formula C11H14Cl2N2 and molecular weight 244.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-1,10-diazatricyclo[6.4.1.04,13]trideca-4(13),5,7-triene;hydrochloride
Also Known As: Pyrrolo(3,2,1-jk)(1,4)benzodiazepine, 9-chloro-1,2,3,4,6,7-hexahydro-, 9-Chloro-1,2,3,4,6,7-hexahydropyrrolo(3,2,1-jk)(1,4)benzodiazepine, Pyrrolo(3,2,1-jk)(1,4)benzodiazepine, 1,2,3,4,6,7-hexahydro-9-chloro-, 9-Chloro-1,2,3,4,6,7-hexahydro[1,4]diazepino[6,7,1-hi]indole--hydrogen chloride (1/1), RefChem:378262
| Molecular Formula | C11H14Cl2N2 |
|---|---|
| Molecular Weight | 244.05 g/mol |
| LogP | 2.2275 |
| Topological Polar Surface Area | 15.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 244.0534 |
| Heavy Atoms | 15 |
| Complexity | 221.0 |
Chemical Identifiers
| CAS Number | 28740-92-3 |
|---|---|
| SMILES | C1CN2CCNCC3=CC(=CC1=C32)Cl.Cl |
| InChIKey | XDVBJSDEOVEXFC-UHFFFAOYSA-N |
Product Overview
Pyrrolo(3,2,1-jk)(1,4)benzodiazepine, 9-chloro-1,2,3,4,6,7-hexahydro- (CAS 28740-92-3), with molecular formula C11H14Cl2N2 and molecular weight 244.05 g/mol. IUPAC: 6-chloro-1,10-diazatricyclo[6.4.1.04,13]trideca-4(13),5,7-triene;hydrochloride.
Chemical Property Profile of Pyrrolo(3,2,1-jk)(1,4)benzodiazepine, 9-chloro-1,2,3,4,6,7-hexahydro-
Property Insights of Pyrrolo(3,2,1-jk)(1,4)benzodiazepine, 9-chloro-1,2,3,4,6,7-hexahydro-
The XLogP value of 2.2275 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrrolo(3,2,1-jk)(1,4)benzodiazepine, 9-chloro-1,2,3,4,6,7-hexahydro-. With a topological polar surface area (TPSA) of 15.3 Ų, Pyrrolo(3,2,1-jk)(1,4)benzodiazepine, 9-chloro-1,2,3,4,6,7-hexahydro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrrolo(3,2,1-jk)(1,4)benzodiazepine, 9-chloro-1,2,3,4,6,7-hexahydro- 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(3,2,1-jk)(1,4)benzodiazepine, 9-chloro-1,2,3,4,6,7-hexahydro-?
The CAS number of Pyrrolo(3,2,1-jk)(1,4)benzodiazepine, 9-chloro-1,2,3,4,6,7-hexahydro- is 28740-92-3.
What is the molecular formula of Pyrrolo(3,2,1-jk)(1,4)benzodiazepine, 9-chloro-1,2,3,4,6,7-hexahydro-?
The molecular formula of Pyrrolo(3,2,1-jk)(1,4)benzodiazepine, 9-chloro-1,2,3,4,6,7-hexahydro- is C11H14Cl2N2.
What is the molecular weight of Pyrrolo(3,2,1-jk)(1,4)benzodiazepine, 9-chloro-1,2,3,4,6,7-hexahydro-?
The molecular weight of Pyrrolo(3,2,1-jk)(1,4)benzodiazepine, 9-chloro-1,2,3,4,6,7-hexahydro- is 244.05 g/mol.
Where can I buy Pyrrolo(3,2,1-jk)(1,4)benzodiazepine, 9-chloro-1,2,3,4,6,7-hexahydro-?
You can request a quote for Pyrrolo(3,2,1-jk)(1,4)benzodiazepine, 9-chloro-1,2,3,4,6,7-hexahydro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrrolo(3,2,1-jk)(1,4)benzodiazepine, 9-chloro-1,2,3,4,6,7-hexahydro-?
Yes, KEHONG BIO provides custom synthesis services for Pyrrolo(3,2,1-jk)(1,4)benzodiazepine, 9-chloro-1,2,3,4,6,7-hexahydro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.