BIM-0019995.P001
TL;DR: BIM-0019995.P001 (CAS 5405-78-7) is a chemical compound with molecular formula C13H10BrNO4S2 and molecular weight 386.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-bromo-6-methoxy-4-[(Z)-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] acetate
Also Known As: BIM-0019995.P001, A1186/0054817, 2-bromo-6-methoxy-4-[(4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl acetate, 2-bromo-6-methoxy-4-[(Z)-(4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl acetate, [2-bromo-6-methoxy-4-[(Z)-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] acetate
| Molecular Formula | C13H10BrNO4S2 |
|---|---|
| Molecular Weight | 386.92 g/mol |
| LogP | 2.8718 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 386.92346 |
| Heavy Atoms | 21 |
| Complexity | 672.38025 |
Chemical Identifiers
| CAS Number | 5405-78-7 |
|---|---|
| SMILES | CC(=O)OC1=C(C=C(C=C1Br)/C=C\2/C(=O)NC(=S)S2)OC |
Product Overview
BIM-0019995.P001 (CAS 5405-78-7), with molecular formula C13H10BrNO4S2 and molecular weight 386.92 g/mol. IUPAC: [2-bromo-6-methoxy-4-[(Z)-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl] acetate.
Chemical Property Profile of BIM-0019995.P001
Property Insights of BIM-0019995.P001
The XLogP value of 2.8718 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BIM-0019995.P001. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0019995.P001. Following Lipinski's Rule of Five, BIM-0019995.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-0019995.P001?
The CAS number of BIM-0019995.P001 is 5405-78-7.
What is the molecular formula of BIM-0019995.P001?
The molecular formula of BIM-0019995.P001 is C13H10BrNO4S2.
What is the molecular weight of BIM-0019995.P001?
The molecular weight of BIM-0019995.P001 is 386.92 g/mol.
Where can I buy BIM-0019995.P001?
You can request a quote for BIM-0019995.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0019995.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0019995.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.