RefChem:203772
TL;DR: RefChem:203772 (CAS 119707-45-8) is a chemical compound with molecular formula C19H16ClN3O4 and molecular weight 385.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-chloro-13-ethyl-8-methyl-1-nitro-12a,13-dihydro-8H-chromeno[2,3-b][1,5]benzodiazepin-7-one
Also Known As: (1)Benzopyrano(2,3-b)(1,5)benzodiazepin-13(5ah)-one, 6,11-dihydro-2-chloro-6-ethyl-1-methyl-7-nitro-, (1)BENZOPYRANO(2,3-b)(1,5)BENZODIAZEPIN-13(5aH)-ONE, 6,11-DIHYDRO-2-CHLORO-6-ETH, 9-chloro-13-ethyl-8-methyl-1-nitro-12a,13-dihydro-8H-chromeno[2,3-b][1,5]benzodiazepin-7-one, 9-Chloro-13-ethyl-8-methyl-1-nitro-12a,13-dihydro[1]benzopyrano[2,3-b][1,5]benzodiazepin-7(8H)-one, 9-chloro-13-ethyl-8-methyl-1-nitro-12a,13-dihydrochromeno[2,3-b][1,5]benzodiazepin-7(8h)-one
| Molecular Formula | C19H16ClN3O4 |
|---|---|
| Molecular Weight | 385.08 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 96.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 385.08295 |
| Heavy Atoms | 27 |
| Complexity | 810.0 |
Chemical Identifiers
| CAS Number | 119707-45-8 |
|---|---|
| SMILES | CCC1C2C=NC3=C(C(=O)C(C(=C3)Cl)C)N=C2OC4=CC=CC(=C14)[N+](=O)[O-] |
| InChIKey | HZYKWFCOYHVUKR-UHFFFAOYSA-N |
Product Overview
RefChem:203772 (CAS 119707-45-8), with molecular formula C19H16ClN3O4 and molecular weight 385.08 g/mol. IUPAC: 9-chloro-13-ethyl-8-methyl-1-nitro-12a,13-dihydro-8H-chromeno[2,3-b][1,5]benzodiazepin-7-one.
Chemical Property Profile of RefChem:203772
Property Insights of RefChem:203772
The XLogP value of 3.4 indicates that RefChem:203772 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.8 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:203772. Following Lipinski's Rule of Five, RefChem:203772 has 0 hydrogen bond donor(s) and 6 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:203772?
The CAS number of RefChem:203772 is 119707-45-8.
What is the molecular formula of RefChem:203772?
The molecular formula of RefChem:203772 is C19H16ClN3O4.
What is the molecular weight of RefChem:203772?
The molecular weight of RefChem:203772 is 385.08 g/mol.
Where can I buy RefChem:203772?
You can request a quote for RefChem:203772 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:203772?
Yes, KEHONG BIO provides custom synthesis services for RefChem:203772 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.