BAS 00656287
TL;DR: BAS 00656287 (CAS 147424-22-4) is a chemical compound with molecular formula C23H28N2O4 and molecular weight 396.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2',6'-ditert-butyl-2-ethenyl-7-nitrospiro[2,4-dihydro-1,4-benzoxazine-3,4'-cyclohexa-2,5-diene]-1'-one
Also Known As: BAS 00656287, 2',6'-ditert-butyl-2-ethenyl-7-nitrospiro[2,4-dihydro-1,4-benzoxazine-3,4'-cyclohexa-2,5-diene]-1'-one, 2',6'-ditert-butyl-7-nitro-2-vinyl-3,4-dihydrospiro[2H-1,4-benzoxazine-3,4'-[2,5]cyclohexadien]-1'-one, 12,16-bis(tert-butyl)-7-nitro-2-vinylspiro[2H,4H-benzo[e]1,4-oxazine-3,4'-cycl ohexane]a-12,15-dien-11-one, 3',5'-di-tert-butyl-2-ethenyl-7-nitro-2,4-dihydrospiro[1,4-benzoxazine-3,1'-cyclohexane]-2',5'-dien-4'-one
| Molecular Formula | C23H28N2O4 |
|---|---|
| Molecular Weight | 396.20 g/mol |
| LogP | 5.2202 |
| Topological Polar Surface Area | 81.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 396.2049 |
| Heavy Atoms | 29 |
| Complexity | 924.07043 |
Chemical Identifiers
| CAS Number | 147424-22-4 |
|---|---|
| SMILES | CC(C)(C)C1=CC2(C=C(C1=O)C(C)(C)C)C(OC3=C(N2)C=CC(=C3)[N+](=O)[O-])C=C |
Product Overview
BAS 00656287 (CAS 147424-22-4), with molecular formula C23H28N2O4 and molecular weight 396.20 g/mol. IUPAC: 2',6'-ditert-butyl-2-ethenyl-7-nitrospiro[2,4-dihydro-1,4-benzoxazine-3,4'-cyclohexa-2,5-diene]-1'-one.
Chemical Property Profile of BAS 00656287
Property Insights of BAS 00656287
The XLogP value of 5.2202 indicates that BAS 00656287 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.47 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00656287. Following Lipinski's Rule of Five, BAS 00656287 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00656287?
The CAS number of BAS 00656287 is 147424-22-4.
What is the molecular formula of BAS 00656287?
The molecular formula of BAS 00656287 is C23H28N2O4.
What is the molecular weight of BAS 00656287?
The molecular weight of BAS 00656287 is 396.20 g/mol.
Where can I buy BAS 00656287?
You can request a quote for BAS 00656287 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00656287?
Yes, KEHONG BIO provides custom synthesis services for BAS 00656287 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.