BAS 00720937
TL;DR: BAS 00720937 (CAS 331972-80-6) is a chemical compound with molecular formula C28H14Cl2N2O4 and molecular weight 512.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-chlorophenyl)-6-[2-(2-chlorophenyl)-4-oxo-3,1-benzoxazin-6-yl]-3,1-benzoxazin-4-one
Also Known As: BAS 00720937, BIM-0009462.P001, 2-(2-chlorophenyl)-6-[2-(2-chlorophenyl)-4-oxo-3,1-benzoxazin-6-yl]-3,1-benzoxazin-4-one, 2,2'-bis(2-chlorophenyl)-4H,4'H-6,6'-bi-3,1-benzoxazine-4,4'-dione, 2,2'-Bis-(2-chloro-phenyl)-[6,6']bi[benzo[d][1,3]oxazinyl]-4,4'-dione
| Molecular Formula | C28H14Cl2N2O4 |
|---|---|
| Molecular Weight | 512.03 g/mol |
| LogP | 6.9972 |
| Topological Polar Surface Area | 86.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 512.0331 |
| Heavy Atoms | 36 |
| Complexity | 1787.5142 |
Chemical Identifiers
| CAS Number | 331972-80-6 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C2=NC3=C(C=C(C=C3)C4=CC5=C(C=C4)N=C(OC5=O)C6=CC=CC=C6Cl)C(=O)O2)Cl |
Product Overview
BAS 00720937 (CAS 331972-80-6), with molecular formula C28H14Cl2N2O4 and molecular weight 512.03 g/mol. IUPAC: 2-(2-chlorophenyl)-6-[2-(2-chlorophenyl)-4-oxo-3,1-benzoxazin-6-yl]-3,1-benzoxazin-4-one.
Chemical Property Profile of BAS 00720937
Property Insights of BAS 00720937
The XLogP value of 6.9972 indicates that BAS 00720937 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.2 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00720937. Following Lipinski's Rule of Five, BAS 00720937 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00720937?
The CAS number of BAS 00720937 is 331972-80-6.
What is the molecular formula of BAS 00720937?
The molecular formula of BAS 00720937 is C28H14Cl2N2O4.
What is the molecular weight of BAS 00720937?
The molecular weight of BAS 00720937 is 512.03 g/mol.
Where can I buy BAS 00720937?
You can request a quote for BAS 00720937 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00720937?
Yes, KEHONG BIO provides custom synthesis services for BAS 00720937 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.