BIM-0049532.P001
TL;DR: BIM-0049532.P001 (CAS 5952-09-0) is a chemical compound with molecular formula C11H6Cl2N2O3S and molecular weight 315.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(3,5-dichloro-4-hydroxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: BIM-0049532.P001, 5-[(3,5-dichloro-4-hydroxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione, 5-[(3,5-Dichloro-4-hydroxyphenyl)methylidene]-2-sulfanylidenedihydropyrimidine-4,6(1H,5H)-dione
| Molecular Formula | C11H6Cl2N2O3S |
|---|---|
| Molecular Weight | 315.95 g/mol |
| LogP | 1.6133 |
| Topological Polar Surface Area | 78.43 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 315.94763 |
| Heavy Atoms | 19 |
| Complexity | 597.82263 |
Chemical Identifiers
| CAS Number | 5952-09-0 |
|---|---|
| SMILES | C1=C(C=C(C(=C1Cl)O)Cl)C=C2C(=O)NC(=S)NC2=O |
Product Overview
BIM-0049532.P001 (CAS 5952-09-0), with molecular formula C11H6Cl2N2O3S and molecular weight 315.95 g/mol. IUPAC: 5-[(3,5-dichloro-4-hydroxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione.
Chemical Property Profile of BIM-0049532.P001
Property Insights of BIM-0049532.P001
The XLogP value of 1.6133 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BIM-0049532.P001. The TPSA of 78.43 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0049532.P001. Following Lipinski's Rule of Five, BIM-0049532.P001 has 3 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-0049532.P001?
The CAS number of BIM-0049532.P001 is 5952-09-0.
What is the molecular formula of BIM-0049532.P001?
The molecular formula of BIM-0049532.P001 is C11H6Cl2N2O3S.
What is the molecular weight of BIM-0049532.P001?
The molecular weight of BIM-0049532.P001 is 315.95 g/mol.
Where can I buy BIM-0049532.P001?
You can request a quote for BIM-0049532.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0049532.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0049532.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.