SAS 537
TL;DR: SAS 537 (CAS 18035-92-2) is a chemical compound with molecular formula C25H21ClN2O6 and molecular weight 480.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(7-chloro-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl) 3,4,5-trimethoxybenzoate
Also Known As: J1.605.009A, 7-Chloro-1,3-dihydro-3-(3,4,5-trimethoxybenzoyloxy)-5-phenyl-2H-1,4-benzodiazepin-2-one, Benzoic acid, 3,4,5-trimethoxy-, ester with 7-chloro-1,3-dihydro-3-hydroxy-5-phenyl-2H-1,4-benzodiazepin-2-one, 7-Chloro-2,3-dihydro-2-oxo-5-phenyl-1H-1,4-benzodiazepin-3-yl 3,4,5-trimethoxybenzoate, (7-Chloro-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)3,4,5-trimethoxybenzoate
| Molecular Formula | C25H21ClN2O6 |
|---|---|
| Molecular Weight | 480.11 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 95.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 480.10883 |
| Heavy Atoms | 34 |
| Complexity | 744.0 |
Chemical Identifiers
| CAS Number | 18035-92-2 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C(=O)OC2C(=O)NC3=C(C=C(C=C3)Cl)C(=N2)C4=CC=CC=C4 |
| InChIKey | KKBASWQAOUMPNG-UHFFFAOYSA-N |
Product Overview
SAS 537 (CAS 18035-92-2), with molecular formula C25H21ClN2O6 and molecular weight 480.11 g/mol. IUPAC: (7-chloro-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl) 3,4,5-trimethoxybenzoate.
Chemical Property Profile of SAS 537
Property Insights of SAS 537
The XLogP value of 4.5 indicates that SAS 537 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.5 Ų falls within the moderate polarity range, balancing permeability and solubility for SAS 537. Following Lipinski's Rule of Five, SAS 537 has 1 hydrogen bond donor(s) and 7 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 SAS 537?
The CAS number of SAS 537 is 18035-92-2.
What is the molecular formula of SAS 537?
The molecular formula of SAS 537 is C25H21ClN2O6.
What is the molecular weight of SAS 537?
The molecular weight of SAS 537 is 480.11 g/mol.
Where can I buy SAS 537?
You can request a quote for SAS 537 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SAS 537?
Yes, KEHONG BIO provides custom synthesis services for SAS 537 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.