BAS 02557592
TL;DR: BAS 02557592 (CAS 376622-18-3) is a chemical compound with molecular formula C23H19N3O3 and molecular weight 385.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-[3-(benzotriazol-1-ylmethyl)-4-methoxyphenyl]-1-(4-hydroxyphenyl)prop-2-en-1-one
Also Known As: BAS 02557592, (E)-3-[3-(benzotriazol-1-ylmethyl)-4-methoxyphenyl]-1-(4-hydroxyphenyl)prop-2-en-1-one, (2E)-3-[3-(1H-benzotriazol-1-ylmethyl)-4-methoxyphenyl]-1-(4-hydroxyphenyl)prop-2-en-1-one, 3-(3-Benzotriazol-1-ylmethyl-4-methoxy-phenyl)-1-(4-hydroxy-phenyl)-propenone, (E)-3-(3-((1H-benzo[d][1,2,3]triazol-1-yl)methyl)-4-methoxyphenyl)-1-(4-hydroxyphenyl)prop-2-en-1-one
| Molecular Formula | C23H19N3O3 |
|---|---|
| Molecular Weight | 385.14 g/mol |
| LogP | 4.0899 |
| Topological Polar Surface Area | 77.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 385.14264 |
| Heavy Atoms | 29 |
| Complexity | 1193.7051 |
Chemical Identifiers
| CAS Number | 376622-18-3 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)/C=C/C(=O)C2=CC=C(C=C2)O)CN3C4=CC=CC=C4N=N3 |
Product Overview
BAS 02557592 (CAS 376622-18-3), with molecular formula C23H19N3O3 and molecular weight 385.14 g/mol. IUPAC: (E)-3-[3-(benzotriazol-1-ylmethyl)-4-methoxyphenyl]-1-(4-hydroxyphenyl)prop-2-en-1-one.
Chemical Property Profile of BAS 02557592
Property Insights of BAS 02557592
The XLogP value of 4.0899 indicates that BAS 02557592 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.24 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02557592. Following Lipinski's Rule of Five, BAS 02557592 has 1 hydrogen bond donor(s) and 5 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 BAS 02557592?
The CAS number of BAS 02557592 is 376622-18-3.
What is the molecular formula of BAS 02557592?
The molecular formula of BAS 02557592 is C23H19N3O3.
What is the molecular weight of BAS 02557592?
The molecular weight of BAS 02557592 is 385.14 g/mol.
Where can I buy BAS 02557592?
You can request a quote for BAS 02557592 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02557592?
Yes, KEHONG BIO provides custom synthesis services for BAS 02557592 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.