5H-Dibenzo(d,f)(1,3)diazepine, 6-(1-pyrrolidinyl)-, monohydrochloride
TL;DR: 5H-Dibenzo(d,f)(1,3)diazepine, 6-(1-pyrrolidinyl)-, monohydrochloride (CAS 2849-08-3) is a chemical compound with molecular formula C17H18ClN3 and molecular weight 299.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-pyrrolidin-1-ium-1-yl-7H-benzo[d][1,3]benzodiazepine chloride
Also Known As: 6-(1-Pyrrolidinyl)-5H-dibenzo(d,f)(1,3)diazepine hydrochloride, 5H-DIBENZO(d,f)(1,3)DIAZEPINE, 6-(1-PYRROLIDINYL)-, MONOHYDROCHLORIDE, 6-pyrrolidin-1-ium-1-yl-7H-benzo[d][1,3]benzodiazepine chloride, RefChem:305632
| Molecular Formula | C17H18ClN3 |
|---|---|
| Molecular Weight | 299.12 g/mol |
| LogP | -0.55 |
| Topological Polar Surface Area | 28.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 299.11893 |
| Heavy Atoms | 21 |
| Complexity | 372.0 |
Chemical Identifiers
| CAS Number | 2849-08-3 |
|---|---|
| SMILES | C1CC[NH+](C1)C2=NC3=CC=CC=C3C4=CC=CC=C4N2.[Cl-] |
| InChIKey | JRJJNOZBFSJAID-UHFFFAOYSA-N |
Product Overview
5H-Dibenzo(d,f)(1,3)diazepine, 6-(1-pyrrolidinyl)-, monohydrochloride (CAS 2849-08-3), with molecular formula C17H18ClN3 and molecular weight 299.12 g/mol. IUPAC: 6-pyrrolidin-1-ium-1-yl-7H-benzo[d][1,3]benzodiazepine chloride.
Chemical Property Profile of 5H-Dibenzo(d,f)(1,3)diazepine, 6-(1-pyrrolidinyl)-, monohydrochloride
Property Insights of 5H-Dibenzo(d,f)(1,3)diazepine, 6-(1-pyrrolidinyl)-, monohydrochloride
The XLogP value of -0.55 indicates that 5H-Dibenzo(d,f)(1,3)diazepine, 6-(1-pyrrolidinyl)-, monohydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 28.8 Ų, 5H-Dibenzo(d,f)(1,3)diazepine, 6-(1-pyrrolidinyl)-, monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5H-Dibenzo(d,f)(1,3)diazepine, 6-(1-pyrrolidinyl)-, monohydrochloride 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 5H-Dibenzo(d,f)(1,3)diazepine, 6-(1-pyrrolidinyl)-, monohydrochloride?
The CAS number of 5H-Dibenzo(d,f)(1,3)diazepine, 6-(1-pyrrolidinyl)-, monohydrochloride is 2849-08-3.
What is the molecular formula of 5H-Dibenzo(d,f)(1,3)diazepine, 6-(1-pyrrolidinyl)-, monohydrochloride?
The molecular formula of 5H-Dibenzo(d,f)(1,3)diazepine, 6-(1-pyrrolidinyl)-, monohydrochloride is C17H18ClN3.
What is the molecular weight of 5H-Dibenzo(d,f)(1,3)diazepine, 6-(1-pyrrolidinyl)-, monohydrochloride?
The molecular weight of 5H-Dibenzo(d,f)(1,3)diazepine, 6-(1-pyrrolidinyl)-, monohydrochloride is 299.12 g/mol.
Where can I buy 5H-Dibenzo(d,f)(1,3)diazepine, 6-(1-pyrrolidinyl)-, monohydrochloride?
You can request a quote for 5H-Dibenzo(d,f)(1,3)diazepine, 6-(1-pyrrolidinyl)-, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5H-Dibenzo(d,f)(1,3)diazepine, 6-(1-pyrrolidinyl)-, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 5H-Dibenzo(d,f)(1,3)diazepine, 6-(1-pyrrolidinyl)-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.