BIM-0040592.P001
TL;DR: BIM-0040592.P001 (CAS 5997-88-6) is a chemical compound with molecular formula C19H15BrN2O3S and molecular weight 430.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-1-(4-bromo-2-methylphenyl)-5-[(2-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: BIM-0040592.P001, 1-(4-bromo-2-methylphenyl)-5-(2-methoxybenzylidene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione, (5E)-1-(4-bromo-2-methylphenyl)-5-[(2-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
| Molecular Formula | C19H15BrN2O3S |
|---|---|
| Molecular Weight | 430.00 g/mol |
| LogP | 3.59742 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 429.9987 |
| Heavy Atoms | 26 |
| Complexity | 955.5505 |
Chemical Identifiers
| CAS Number | 5997-88-6 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)Br)N2C(=O)/C(=C/C3=CC=CC=C3OC)/C(=O)NC2=S |
Product Overview
BIM-0040592.P001 (CAS 5997-88-6), with molecular formula C19H15BrN2O3S and molecular weight 430.00 g/mol. IUPAC: (5E)-1-(4-bromo-2-methylphenyl)-5-[(2-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione.
Chemical Property Profile of BIM-0040592.P001
Property Insights of BIM-0040592.P001
The XLogP value of 3.59742 indicates that BIM-0040592.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.64 Ų, BIM-0040592.P001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BIM-0040592.P001 has 1 hydrogen bond donor(s) and 4 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-0040592.P001?
The CAS number of BIM-0040592.P001 is 5997-88-6.
What is the molecular formula of BIM-0040592.P001?
The molecular formula of BIM-0040592.P001 is C19H15BrN2O3S.
What is the molecular weight of BIM-0040592.P001?
The molecular weight of BIM-0040592.P001 is 430.00 g/mol.
Where can I buy BIM-0040592.P001?
You can request a quote for BIM-0040592.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0040592.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0040592.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.