BAS 00431657
TL;DR: BAS 00431657 (CAS 300591-65-5) is a chemical compound with molecular formula C27H19N3O3 and molecular weight 433.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-[5-[(2-hydroxyphenyl)methylideneamino]-1,3-benzoxazol-2-yl]phenyl]iminomethyl]phenol
Also Known As: BAS 00431657, (6Z)-6-[[4-[5-[[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]-1,3-benzoxazol-2-yl]anilino]methylidene]cyclohexa-2,4-dien-1-one, 2-((E)-((4-(5-((E)-(2-hydroxybenzylidene)amino)benzo[d]oxazol-2-yl)phenyl)imino)methyl)phenol, 2-[(1Z)-2-(2-{4-[(1Z)-2-(2-hydroxyphenyl)-1-azavinyl]phenyl}benzoxazol-5-yl)-2 -azavinyl]phenol, 2-[(E)-{[4-(5-{[(E)-(2-hydroxyphenyl)methylidene]amino}-1,3-benzoxazol-2-yl)phenyl]imino}methyl]phenol
| Molecular Formula | C27H19N3O3 |
|---|---|
| Molecular Weight | 433.14 g/mol |
| LogP | 6.4072 |
| Topological Polar Surface Area | 91.21 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 433.14264 |
| Heavy Atoms | 33 |
| Complexity | 1484.5773 |
Chemical Identifiers
| CAS Number | 300591-65-5 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C=NC2=CC=C(C=C2)C3=NC4=C(O3)C=CC(=C4)N=CC5=CC=CC=C5O)O |
Product Overview
BAS 00431657 (CAS 300591-65-5), with molecular formula C27H19N3O3 and molecular weight 433.14 g/mol. IUPAC: 2-[[4-[5-[(2-hydroxyphenyl)methylideneamino]-1,3-benzoxazol-2-yl]phenyl]iminomethyl]phenol.
Chemical Property Profile of BAS 00431657
Property Insights of BAS 00431657
The XLogP value of 6.4072 indicates that BAS 00431657 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.21 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00431657. Following Lipinski's Rule of Five, BAS 00431657 has 2 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 00431657?
The CAS number of BAS 00431657 is 300591-65-5.
What is the molecular formula of BAS 00431657?
The molecular formula of BAS 00431657 is C27H19N3O3.
What is the molecular weight of BAS 00431657?
The molecular weight of BAS 00431657 is 433.14 g/mol.
Where can I buy BAS 00431657?
You can request a quote for BAS 00431657 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00431657?
Yes, KEHONG BIO provides custom synthesis services for BAS 00431657 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.