BAS 02232491
TL;DR: BAS 02232491 (CAS 352219-56-8) is a chemical compound with molecular formula C19H20N6OS and molecular weight 380.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzothiazol-2-yl)-4-[N-(3-imidazol-1-ylpropyl)-C-methylcarbonimidoyl]-5-methyl-1H-pyrazol-3-one
Also Known As: BAS 02232491, (E)-4-(1-((3-(1H-imidazol-1-yl)propyl)imino)ethyl)-2-(benzo[d]thiazol-2-yl)-5-methyl-1H-pyrazol-3(2H)-one, (4E)-2-(1,3-benzothiazol-2-yl)-4-[1-(3-imidazol-1-ylpropylamino)ethylidene]-5-methylpyrazol-3-one, 1-(1,3-benzothiazol-2-yl)-4-{(1Z)-N-[3-(1H-imidazol-1-yl)propyl]ethanimidoyl}-3-methyl-1H-pyrazol-5-ol, 2-(1,3-benzothiazol-2-yl)-4-(1-{[3-(1H-imidazol-1-yl)propyl]amino}ethylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
| Molecular Formula | C19H20N6OS |
|---|---|
| Molecular Weight | 380.14 g/mol |
| LogP | 3.17952 |
| Topological Polar Surface Area | 80.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 380.14194 |
| Heavy Atoms | 27 |
| Complexity | 1115.766 |
Chemical Identifiers
| CAS Number | 352219-56-8 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1)C2=NC3=CC=CC=C3S2)C(=NCCCN4C=CN=C4)C |
Product Overview
BAS 02232491 (CAS 352219-56-8), with molecular formula C19H20N6OS and molecular weight 380.14 g/mol. IUPAC: 2-(1,3-benzothiazol-2-yl)-4-[N-(3-imidazol-1-ylpropyl)-C-methylcarbonimidoyl]-5-methyl-1H-pyrazol-3-one.
Chemical Property Profile of BAS 02232491
Property Insights of BAS 02232491
The XLogP value of 3.17952 indicates that BAS 02232491 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.86 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02232491. Following Lipinski's Rule of Five, BAS 02232491 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 02232491?
The CAS number of BAS 02232491 is 352219-56-8.
What is the molecular formula of BAS 02232491?
The molecular formula of BAS 02232491 is C19H20N6OS.
What is the molecular weight of BAS 02232491?
The molecular weight of BAS 02232491 is 380.14 g/mol.
Where can I buy BAS 02232491?
You can request a quote for BAS 02232491 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02232491?
Yes, KEHONG BIO provides custom synthesis services for BAS 02232491 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.