BIM-0039335.P001
TL;DR: BIM-0039335.P001 (CAS 340306-22-1) is a chemical compound with molecular formula C19H15N3O5S and molecular weight 397.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[[5-(2-methyl-5-nitrophenyl)furan-2-yl]methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: BIM-0039335.P001, (5Z)-5-[[5-(2-methyl-5-nitrophenyl)furan-2-yl]methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione, (5Z)-5-{[5-(2-methyl-5-nitrophenyl)furan-2-yl]methylidene}-1-(prop-2-en-1-yl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione, (Z)-1-allyl-5-((5-(2-methyl-5-nitrophenyl)furan-2-yl)methylene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
| Molecular Formula | C19H15N3O5S |
|---|---|
| Molecular Weight | 397.07 g/mol |
| LogP | 2.97592 |
| Topological Polar Surface Area | 105.69 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 397.07324 |
| Heavy Atoms | 28 |
| Complexity | 1053.5886 |
Chemical Identifiers
| CAS Number | 340306-22-1 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)[N+](=O)[O-])C2=CC=C(O2)/C=C\3/C(=O)NC(=S)N(C3=O)CC=C |
Product Overview
BIM-0039335.P001 (CAS 340306-22-1), with molecular formula C19H15N3O5S and molecular weight 397.07 g/mol. IUPAC: (5Z)-5-[[5-(2-methyl-5-nitrophenyl)furan-2-yl]methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione.
Chemical Property Profile of BIM-0039335.P001
Property Insights of BIM-0039335.P001
The XLogP value of 2.97592 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BIM-0039335.P001. The TPSA of 105.69 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0039335.P001. Following Lipinski's Rule of Five, BIM-0039335.P001 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 BIM-0039335.P001?
The CAS number of BIM-0039335.P001 is 340306-22-1.
What is the molecular formula of BIM-0039335.P001?
The molecular formula of BIM-0039335.P001 is C19H15N3O5S.
What is the molecular weight of BIM-0039335.P001?
The molecular weight of BIM-0039335.P001 is 397.07 g/mol.
Where can I buy BIM-0039335.P001?
You can request a quote for BIM-0039335.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0039335.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0039335.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.