BIM-0039128.P001
TL;DR: BIM-0039128.P001 (CAS 340230-22-0) is a chemical compound with molecular formula C21H21N3O2S and molecular weight 379.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: BIM-0039128.P001, AH-487/15149082, (5Z)-5-[[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione, (5Z)-5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylidene}-1-(prop-2-en-1-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione, (5Z)-5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylidene}-1-(prop-2-en-1-yl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
| Molecular Formula | C21H21N3O2S |
|---|---|
| Molecular Weight | 379.14 g/mol |
| LogP | 3.21526 |
| Topological Polar Surface Area | 54.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 379.13544 |
| Heavy Atoms | 27 |
| Complexity | 983.6008 |
Chemical Identifiers
| CAS Number | 340230-22-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=CC(=C2C)/C=C\3/C(=O)NC(=S)N(C3=O)CC=C)C |
Product Overview
BIM-0039128.P001 (CAS 340230-22-0), with molecular formula C21H21N3O2S and molecular weight 379.14 g/mol. IUPAC: (5Z)-5-[[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione.
Chemical Property Profile of BIM-0039128.P001
Property Insights of BIM-0039128.P001
The XLogP value of 3.21526 indicates that BIM-0039128.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.34 Ų, BIM-0039128.P001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BIM-0039128.P001 has 1 hydrogen bond donor(s) and 3 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 BIM-0039128.P001?
The CAS number of BIM-0039128.P001 is 340230-22-0.
What is the molecular formula of BIM-0039128.P001?
The molecular formula of BIM-0039128.P001 is C21H21N3O2S.
What is the molecular weight of BIM-0039128.P001?
The molecular weight of BIM-0039128.P001 is 379.14 g/mol.
Where can I buy BIM-0039128.P001?
You can request a quote for BIM-0039128.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0039128.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0039128.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.