![10-chloro-7-methyl-2,5,6,11b-tetrahydro-1H-pyrrolo[1,2-d][1,4]benzodiazepin-3-one structure](/static/products/864/86436-52-4.png)
10-chloro-7-methyl-2,5,6,11b-tetrahydro-1H-pyrrolo[1,2-d][1,4]benzodiazepin-3-one
TL;DR: 10-chloro-7-methyl-2,5,6,11b-tetrahydro-1H-pyrrolo[1,2-d][1,4]benzodiazepin-3-one (CAS 86436-52-4) is a chemical compound with molecular formula C13H15ClN2O and molecular weight 250.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-chloro-7-methyl-2,5,6,11b-tetrahydro-1H-pyrrolo[1,2-d][1,4]benzodiazepin-3-one
Also Known As: 10-chloro-7-methyl-2,5,6,11b-tetrahydro-1H-pyrrolo[1,2-d][1,4]benzodiazepin-3-one, 10-chloro-7-methyl-2,5,6,11b-tetrahydro-1H-pyrrolo[1,2-d][1,, 10-Chloro-7-methyl-1,2,5,6,7,11b-hexahydro-3H-pyrrolo[1,2-d][1,4]benzodiazepin-3-one
| Molecular Formula | C13H15ClN2O |
|---|---|
| Molecular Weight | 250.09 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 23.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 250.0873 |
| Heavy Atoms | 17 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 86436-52-4 |
|---|---|
| SMILES | CN1CCN2C(CCC2=O)C3=C1C=CC(=C3)Cl |
| InChIKey | JTYVYWCGRXSNPF-UHFFFAOYSA-N |
Product Overview
10-chloro-7-methyl-2,5,6,11b-tetrahydro-1H-pyrrolo[1,2-d][1,4]benzodiazepin-3-one (CAS 86436-52-4), with molecular formula C13H15ClN2O and molecular weight 250.09 g/mol. IUPAC: 10-chloro-7-methyl-2,5,6,11b-tetrahydro-1H-pyrrolo[1,2-d][1,4]benzodiazepin-3-one.
Chemical Property Profile of 10-chloro-7-methyl-2,5,6,11b-tetrahydro-1H-pyrrolo[1,2-d][1,4]benzodiazepin-3-one
Property Insights of 10-chloro-7-methyl-2,5,6,11b-tetrahydro-1H-pyrrolo[1,2-d][1,4]benzodiazepin-3-one
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 10-chloro-7-methyl-2,5,6,11b-tetrahydro-1H-pyrrolo[1,2-d][1,4]benzodiazepin-3-one. With a topological polar surface area (TPSA) of 23.6 Ų, 10-chloro-7-methyl-2,5,6,11b-tetrahydro-1H-pyrrolo[1,2-d][1,4]benzodiazepin-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 10-chloro-7-methyl-2,5,6,11b-tetrahydro-1H-pyrrolo[1,2-d][1,4]benzodiazepin-3-one has 0 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 10-chloro-7-methyl-2,5,6,11b-tetrahydro-1H-pyrrolo[1,2-d][1,4]benzodiazepin-3-one?
The CAS number of 10-chloro-7-methyl-2,5,6,11b-tetrahydro-1H-pyrrolo[1,2-d][1,4]benzodiazepin-3-one is 86436-52-4.
What is the molecular formula of 10-chloro-7-methyl-2,5,6,11b-tetrahydro-1H-pyrrolo[1,2-d][1,4]benzodiazepin-3-one?
The molecular formula of 10-chloro-7-methyl-2,5,6,11b-tetrahydro-1H-pyrrolo[1,2-d][1,4]benzodiazepin-3-one is C13H15ClN2O.
What is the molecular weight of 10-chloro-7-methyl-2,5,6,11b-tetrahydro-1H-pyrrolo[1,2-d][1,4]benzodiazepin-3-one?
The molecular weight of 10-chloro-7-methyl-2,5,6,11b-tetrahydro-1H-pyrrolo[1,2-d][1,4]benzodiazepin-3-one is 250.09 g/mol.
Where can I buy 10-chloro-7-methyl-2,5,6,11b-tetrahydro-1H-pyrrolo[1,2-d][1,4]benzodiazepin-3-one?
You can request a quote for 10-chloro-7-methyl-2,5,6,11b-tetrahydro-1H-pyrrolo[1,2-d][1,4]benzodiazepin-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 10-chloro-7-methyl-2,5,6,11b-tetrahydro-1H-pyrrolo[1,2-d][1,4]benzodiazepin-3-one?
Yes, KEHONG BIO provides custom synthesis services for 10-chloro-7-methyl-2,5,6,11b-tetrahydro-1H-pyrrolo[1,2-d][1,4]benzodiazepin-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.