BAS 02251931
TL;DR: BAS 02251931 (CAS 361995-77-9) is a chemical compound with molecular formula C24H22N4O2S2 and molecular weight 462.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[[9-methyl-4-oxo-2-(prop-2-enylamino)pyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-(2-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: BAS 02251931, 2-(allylamino)-9-methyl-3-{(Z)-[4-oxo-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one, (Z)-5-((2-(allylamino)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-3-phenethyl-2-thioxothiazolidin-4-one, (5Z)-5-({9-METHYL-4-OXO-2-[(PROP-2-EN-1-YL)AMINO]-4H-PYRIDO[1,2-A]PYRIMIDIN-3-YL}METHYLIDENE)-3-(2-PHENYLETHYL)-2-SULFANYLIDENE-1,3-THIAZOLIDIN-4-ONE, (5Z)-5-[[9-methyl-4-oxo-2-(prop-2-enylamino)pyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-phenethyl-2-sulfanylidene-1,3-thiazolidin-4-one
| Molecular Formula | C24H22N4O2S2 |
|---|---|
| Molecular Weight | 462.12 g/mol |
| LogP | 4.04472 |
| Topological Polar Surface Area | 66.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 462.1184 |
| Heavy Atoms | 32 |
| Complexity | 1298.5922 |
Chemical Identifiers
| CAS Number | 361995-77-9 |
|---|---|
| SMILES | CC1=CC=CN2C1=NC(=C(C2=O)/C=C\3/C(=O)N(C(=S)S3)CCC4=CC=CC=C4)NCC=C |
Product Overview
BAS 02251931 (CAS 361995-77-9), with molecular formula C24H22N4O2S2 and molecular weight 462.12 g/mol. IUPAC: (5Z)-5-[[9-methyl-4-oxo-2-(prop-2-enylamino)pyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-(2-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of BAS 02251931
Property Insights of BAS 02251931
The XLogP value of 4.04472 indicates that BAS 02251931 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.71 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02251931. Following Lipinski's Rule of Five, BAS 02251931 has 1 hydrogen bond donor(s) and 6 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 02251931?
The CAS number of BAS 02251931 is 361995-77-9.
What is the molecular formula of BAS 02251931?
The molecular formula of BAS 02251931 is C24H22N4O2S2.
What is the molecular weight of BAS 02251931?
The molecular weight of BAS 02251931 is 462.12 g/mol.
Where can I buy BAS 02251931?
You can request a quote for BAS 02251931 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02251931?
Yes, KEHONG BIO provides custom synthesis services for BAS 02251931 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.