RefChem:1073484
TL;DR: RefChem:1073484 (CAS 1163-08-2) is a chemical compound with molecular formula C18H20ClN3O and molecular weight 329.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-5-[2-(dimethylamino)propyl]-11H-benzo[b][1,4]benzodiazepin-6-one
Also Known As: 5-24-04-00114 (Beilstein Handbook Reference), 5H-Dibenzo(b,e)(1,4)diazepin-11-one, 10,11-dihydro-7-chloro-10-(2-(dimethylamino-2-methyl)ethyl)-, 10,11-Dihydro-7-chloro-10-(2-dimethylaminopropyl)-5H-dibenzo[b,e][1,4]diazepin-11-one, 2-chloro-5-[2-(dimethylamino)propyl]-11H-benzo[b][1,4]benzodiazepin-6-one, 7-chloro-10-[2-(dimethylamino)propyl]-5,10-dihydro-11H-dibenzo[b,e][1,4]diazepin-11-one
| Molecular Formula | C18H20ClN3O |
|---|---|
| Molecular Weight | 329.13 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 35.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 329.1295 |
| Heavy Atoms | 23 |
| Complexity | 430.0 |
Chemical Identifiers
| CAS Number | 1163-08-2 |
|---|---|
| SMILES | CC(CN1C2=C(C=C(C=C2)Cl)NC3=CC=CC=C3C1=O)N(C)C |
| InChIKey | QXPFLMFCMKJVLJ-UHFFFAOYSA-N |
Product Overview
RefChem:1073484 (CAS 1163-08-2), with molecular formula C18H20ClN3O and molecular weight 329.13 g/mol. IUPAC: 2-chloro-5-[2-(dimethylamino)propyl]-11H-benzo[b][1,4]benzodiazepin-6-one.
Chemical Property Profile of RefChem:1073484
Property Insights of RefChem:1073484
The XLogP value of 3.7 indicates that RefChem:1073484 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.6 Ų, RefChem:1073484 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1073484 has 1 hydrogen bond donor(s) and 3 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 RefChem:1073484?
The CAS number of RefChem:1073484 is 1163-08-2.
What is the molecular formula of RefChem:1073484?
The molecular formula of RefChem:1073484 is C18H20ClN3O.
What is the molecular weight of RefChem:1073484?
The molecular weight of RefChem:1073484 is 329.13 g/mol.
Where can I buy RefChem:1073484?
You can request a quote for RefChem:1073484 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1073484?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1073484 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.