RefChem:203771
TL;DR: RefChem:203771 (CAS 119707-46-9) is a chemical compound with molecular formula C24H18ClN3O4 and molecular weight 447.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
13-benzyl-9-chloro-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-1-methyl-7-nitro-6-(phenylmethyl)-, (1)BENZOPYRANO(2,3-b)(1,5)BENZODIAZEPIN-13(5aH)-ONE, 6,11-DIHYDRO-2-CHLORO-1-MET, 13-benzyl-9-chloro-8-methyl-1-nitro-12a,13-dihydro-8H-chromeno[2,3-b][1,5]benzodiazepin-7-one, 13-Benzyl-9-chloro-8-methyl-1-nitro-12a,13-dihydro[1]benzopyrano[2,3-b][1,5]benzodiazepin-7(8H)-one, 13-benzyl-9-chloro-8-methyl-1-nitro-12a,13-dihydrochromeno[2,3-b][1,5]benzodiazepin-7(8h)-one
| Molecular Formula | C24H18ClN3O4 |
|---|---|
| Molecular Weight | 447.10 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 96.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 447.09857 |
| Heavy Atoms | 32 |
| Complexity | 928.0 |
Chemical Identifiers
| CAS Number | 119707-46-9 |
|---|---|
| SMILES | CC1C(=CC2=C(C1=O)N=C3C(C=N2)C(C4=C(C=CC=C4O3)[N+](=O)[O-])CC5=CC=CC=C5)Cl |
| InChIKey | DSLWVPMIWHYSCX-UHFFFAOYSA-N |
Product Overview
RefChem:203771 (CAS 119707-46-9), with molecular formula C24H18ClN3O4 and molecular weight 447.10 g/mol. IUPAC: 13-benzyl-9-chloro-8-methyl-1-nitro-12a,13-dihydro-8H-chromeno[2,3-b][1,5]benzodiazepin-7-one.
Chemical Property Profile of RefChem:203771
Property Insights of RefChem:203771
The XLogP value of 4.3 indicates that RefChem:203771 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:203771. Following Lipinski's Rule of Five, RefChem:203771 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:203771?
The CAS number of RefChem:203771 is 119707-46-9.
What is the molecular formula of RefChem:203771?
The molecular formula of RefChem:203771 is C24H18ClN3O4.
What is the molecular weight of RefChem:203771?
The molecular weight of RefChem:203771 is 447.10 g/mol.
Where can I buy RefChem:203771?
You can request a quote for RefChem:203771 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:203771?
Yes, KEHONG BIO provides custom synthesis services for RefChem:203771 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.