IDI1_021525
TL;DR: IDI1_021525 (CAS 374099-24-8) is a chemical compound with molecular formula C18H18N4O2S2 and molecular weight 386.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-3-methyl-5-[(9-methyl-4-oxo-2-pyrrolidin-1-ylpyrido[1,2-a]pyrimidin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: IDI1_021525, 9-methyl-3-[(Z)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-(pyrrolidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one, (5Z)-3-methyl-5-[(9-methyl-4-oxo-2-pyrrolidin-1-ylpyrido[1,2-a]pyrimidin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one, (5Z)-3-METHYL-5-{[9-METHYL-4-OXO-2-(PYRROLIDIN-1-YL)-4H-PYRIDO[1,2-A]PYRIMIDIN-3-YL]METHYLIDENE}-2-SULFANYLIDENE-1,3-THIAZOLIDIN-4-ONE, (Z)-3-methyl-5-((9-methyl-4-oxo-2-(pyrrolidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-2-thioxothiazolidin-4-one
| Molecular Formula | C18H18N4O2S2 |
|---|---|
| Molecular Weight | 386.09 g/mol |
| LogP | 2.43412 |
| Topological Polar Surface Area | 57.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 386.08713 |
| Heavy Atoms | 26 |
| Complexity | 1021.7584 |
Chemical Identifiers
| CAS Number | 374099-24-8 |
|---|---|
| SMILES | CC1=CC=CN2C1=NC(=C(C2=O)/C=C\3/C(=O)N(C(=S)S3)C)N4CCCC4 |
Product Overview
IDI1_021525 (CAS 374099-24-8), with molecular formula C18H18N4O2S2 and molecular weight 386.09 g/mol. IUPAC: (5Z)-3-methyl-5-[(9-methyl-4-oxo-2-pyrrolidin-1-ylpyrido[1,2-a]pyrimidin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of IDI1_021525
Property Insights of IDI1_021525
The XLogP value of 2.43412 suggests moderate lipophilicity, balancing water solubility and membrane permeability for IDI1_021525. With a topological polar surface area (TPSA) of 57.92 Ų, IDI1_021525 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, IDI1_021525 has 0 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 IDI1_021525?
The CAS number of IDI1_021525 is 374099-24-8.
What is the molecular formula of IDI1_021525?
The molecular formula of IDI1_021525 is C18H18N4O2S2.
What is the molecular weight of IDI1_021525?
The molecular weight of IDI1_021525 is 386.09 g/mol.
Where can I buy IDI1_021525?
You can request a quote for IDI1_021525 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for IDI1_021525?
Yes, KEHONG BIO provides custom synthesis services for IDI1_021525 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.