5,10-dihydro-11H-pyrrolo[2,1-c][1,4]benzodiazepin-11-one
TL;DR: 5,10-dihydro-11H-pyrrolo[2,1-c][1,4]benzodiazepin-11-one (CAS 23208-05-1) is a chemical compound with molecular formula C12H10N2O and molecular weight 198.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,11-dihydropyrrolo[2,1-c][1,4]benzodiazepin-6-one
Also Known As: 5,10-dihydro-11H-pyrrolo[2,1-c][1,4]benzodiazepin-11-one, 5,11-dihydropyrrolo[2,1-c][1,4]benzodiazepin-6-one, AH-632/14361007, 5H,10H-Benzo[f]pyrrolo[2,1-c]1,4-diazepin-4-one, 11H-Pyrrolo[2,1-c][1,4]benzodiazepin-11-one, 5,10-dihydro-
| Molecular Formula | C12H10N2O |
|---|---|
| Molecular Weight | 198.08 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 34.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 198.07932 |
| Heavy Atoms | 15 |
| Complexity | 266.0 |
Chemical Identifiers
| CAS Number | 23208-05-1 |
|---|---|
| SMILES | C1C2=CC=CC=C2NC(=O)C3=CC=CN31 |
| InChIKey | QHDPZPSOHTWKAU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5,10-dihydro-11H-pyrrolo[2,1-c][1,4]benzodiazepin-11-one (CAS 23208-05-1), with molecular formula C12H10N2O and molecular weight 198.08 g/mol. IUPAC: 5,11-dihydropyrrolo[2,1-c][1,4]benzodiazepin-6-one.
Chemical Property Profile of 5,10-dihydro-11H-pyrrolo[2,1-c][1,4]benzodiazepin-11-one
Property Insights of 5,10-dihydro-11H-pyrrolo[2,1-c][1,4]benzodiazepin-11-one
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,10-dihydro-11H-pyrrolo[2,1-c][1,4]benzodiazepin-11-one. With a topological polar surface area (TPSA) of 34.0 Ų, 5,10-dihydro-11H-pyrrolo[2,1-c][1,4]benzodiazepin-11-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,10-dihydro-11H-pyrrolo[2,1-c][1,4]benzodiazepin-11-one has 1 hydrogen bond donor(s) and 1 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 5,10-dihydro-11H-pyrrolo[2,1-c][1,4]benzodiazepin-11-one?
The CAS number of 5,10-dihydro-11H-pyrrolo[2,1-c][1,4]benzodiazepin-11-one is 23208-05-1.
What is the molecular formula of 5,10-dihydro-11H-pyrrolo[2,1-c][1,4]benzodiazepin-11-one?
The molecular formula of 5,10-dihydro-11H-pyrrolo[2,1-c][1,4]benzodiazepin-11-one is C12H10N2O.
What is the molecular weight of 5,10-dihydro-11H-pyrrolo[2,1-c][1,4]benzodiazepin-11-one?
The molecular weight of 5,10-dihydro-11H-pyrrolo[2,1-c][1,4]benzodiazepin-11-one is 198.08 g/mol.
Where can I buy 5,10-dihydro-11H-pyrrolo[2,1-c][1,4]benzodiazepin-11-one?
You can request a quote for 5,10-dihydro-11H-pyrrolo[2,1-c][1,4]benzodiazepin-11-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,10-dihydro-11H-pyrrolo[2,1-c][1,4]benzodiazepin-11-one?
Yes, KEHONG BIO provides custom synthesis services for 5,10-dihydro-11H-pyrrolo[2,1-c][1,4]benzodiazepin-11-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.