Pyrrolo(1,2,3-ef)(1,5)benzodiazepine, 1,2,4,5,6,7-hexahydro-, dihydrochloride
TL;DR: Pyrrolo(1,2,3-ef)(1,5)benzodiazepine, 1,2,4,5,6,7-hexahydro-, dihydrochloride (CAS 28740-82-1) is a chemical compound with molecular formula C11H16Cl2N2 and molecular weight 246.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,9-diazatricyclo[6.4.1.04,13]trideca-4(13),5,7-triene;dihydrochloride
Also Known As: Pyrrolo(1,2,3-ef)(1,5)benzodiazepine, 1,2,4,5,6,7-hexahydro-, dihydrochloride, 1,2,4,5,6,7-Hexahydropyrrolo(1,2,3-ef)(1,5)benzodiazepine dihydrochloride, 1,2,4,5,6,7-Hexahydropyrrolo(1,2,3-ef)(1,5)benzodiazepine di, 1,2,3,4,6,7-Hexahydro[1,4]diazepino[3,2,1-hi]indole--hydrogen chloride (1/2), Pyrrolo[1,2,3-ef]-1,5-benzodiazepine, 1,2,3,4,6,7-hexahydro-, dihydrochloride
| Molecular Formula | C11H16Cl2N2 |
|---|---|
| Molecular Weight | 246.07 g/mol |
| LogP | 2.7083 |
| Topological Polar Surface Area | 15.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 246.06906 |
| Heavy Atoms | 15 |
| Complexity | 193.0 |
Chemical Identifiers
| CAS Number | 28740-82-1 |
|---|---|
| SMILES | C1CNC2=CC=CC3=C2N(C1)CC3.Cl.Cl |
| InChIKey | JSNSNNLDACBGSH-UHFFFAOYSA-N |
Product Overview
Pyrrolo(1,2,3-ef)(1,5)benzodiazepine, 1,2,4,5,6,7-hexahydro-, dihydrochloride (CAS 28740-82-1), with molecular formula C11H16Cl2N2 and molecular weight 246.07 g/mol. IUPAC: 1,9-diazatricyclo[6.4.1.04,13]trideca-4(13),5,7-triene;dihydrochloride.
Chemical Property Profile of Pyrrolo(1,2,3-ef)(1,5)benzodiazepine, 1,2,4,5,6,7-hexahydro-, dihydrochloride
Property Insights of Pyrrolo(1,2,3-ef)(1,5)benzodiazepine, 1,2,4,5,6,7-hexahydro-, dihydrochloride
The XLogP value of 2.7083 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrrolo(1,2,3-ef)(1,5)benzodiazepine, 1,2,4,5,6,7-hexahydro-, dihydrochloride. With a topological polar surface area (TPSA) of 15.3 Ų, Pyrrolo(1,2,3-ef)(1,5)benzodiazepine, 1,2,4,5,6,7-hexahydro-, dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrrolo(1,2,3-ef)(1,5)benzodiazepine, 1,2,4,5,6,7-hexahydro-, dihydrochloride has 3 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(1,2,3-ef)(1,5)benzodiazepine, 1,2,4,5,6,7-hexahydro-, dihydrochloride?
The CAS number of Pyrrolo(1,2,3-ef)(1,5)benzodiazepine, 1,2,4,5,6,7-hexahydro-, dihydrochloride is 28740-82-1.
What is the molecular formula of Pyrrolo(1,2,3-ef)(1,5)benzodiazepine, 1,2,4,5,6,7-hexahydro-, dihydrochloride?
The molecular formula of Pyrrolo(1,2,3-ef)(1,5)benzodiazepine, 1,2,4,5,6,7-hexahydro-, dihydrochloride is C11H16Cl2N2.
What is the molecular weight of Pyrrolo(1,2,3-ef)(1,5)benzodiazepine, 1,2,4,5,6,7-hexahydro-, dihydrochloride?
The molecular weight of Pyrrolo(1,2,3-ef)(1,5)benzodiazepine, 1,2,4,5,6,7-hexahydro-, dihydrochloride is 246.07 g/mol.
Where can I buy Pyrrolo(1,2,3-ef)(1,5)benzodiazepine, 1,2,4,5,6,7-hexahydro-, dihydrochloride?
You can request a quote for Pyrrolo(1,2,3-ef)(1,5)benzodiazepine, 1,2,4,5,6,7-hexahydro-, dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrrolo(1,2,3-ef)(1,5)benzodiazepine, 1,2,4,5,6,7-hexahydro-, dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Pyrrolo(1,2,3-ef)(1,5)benzodiazepine, 1,2,4,5,6,7-hexahydro-, dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.