BAS 06574728
TL;DR: BAS 06574728 (CAS 694456-91-2) is a chemical compound with molecular formula C24H19N3OS2 and molecular weight 429.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methylphenyl]-2-methylphthalazin-1-one
Also Known As: BAS 06574728, 4-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methylphenyl]-2-methylphthalazin-1-one, 4-{3-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-4-methylphenyl}-2-methylphthalazin-1(2H)-one, 4-(3-((benzo[d]thiazol-2-ylthio)methyl)-4-methylphenyl)-2-methylphthalazin-1(2H)-one
| Molecular Formula | C24H19N3OS2 |
|---|---|
| Molecular Weight | 429.10 g/mol |
| LogP | 5.81092 |
| Topological Polar Surface Area | 47.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 429.09695 |
| Heavy Atoms | 30 |
| Complexity | 1419.3739 |
Chemical Identifiers
| CAS Number | 694456-91-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)C)CSC4=NC5=CC=CC=C5S4 |
Product Overview
BAS 06574728 (CAS 694456-91-2), with molecular formula C24H19N3OS2 and molecular weight 429.10 g/mol. IUPAC: 4-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methylphenyl]-2-methylphthalazin-1-one.
Chemical Property Profile of BAS 06574728
Property Insights of BAS 06574728
The XLogP value of 5.81092 indicates that BAS 06574728 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.78 Ų, BAS 06574728 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 06574728 has 0 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 06574728?
The CAS number of BAS 06574728 is 694456-91-2.
What is the molecular formula of BAS 06574728?
The molecular formula of BAS 06574728 is C24H19N3OS2.
What is the molecular weight of BAS 06574728?
The molecular weight of BAS 06574728 is 429.10 g/mol.
Where can I buy BAS 06574728?
You can request a quote for BAS 06574728 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06574728?
Yes, KEHONG BIO provides custom synthesis services for BAS 06574728 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.