SDCCGSBI-0660804.P001
TL;DR: SDCCGSBI-0660804.P001 (CAS 302549-25-3) is a chemical compound with molecular formula C12H8BrN3O2S and molecular weight 336.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(5-bromo-2-hydroxy-1-methylindol-3-yl)-2-sulfanylideneimidazol-4-one
Also Known As: SDCCGSBI-0660804.P001, AB00096364-01, (3Z)-5-bromo-1-methyl-3-(5-oxo-2-thioxoimidazolidin-4-ylidene)-1,3-dihydro-2H-indol-2-one, (3Z)-5-bromo-1-methyl-3-(5-oxo-2-sulfanylideneimidazolidin-4-ylidene)indol-2-one, (Z)-5-bromo-1-methyl-3-(5-oxo-2-thioxoimidazolidin-4-ylidene)indolin-2-one
| Molecular Formula | C12H8BrN3O2S |
|---|---|
| Molecular Weight | 336.95 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 98.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 336.95206 |
| Heavy Atoms | 19 |
| Complexity | 470.0 |
Chemical Identifiers
| CAS Number | 302549-25-3 |
|---|---|
| SMILES | CN1C2=C(C=C(C=C2)Br)C(=C1O)C3=NC(=S)NC3=O |
| InChIKey | IRRPIHIZURATJY-UHFFFAOYSA-N |
Product Overview
SDCCGSBI-0660804.P001 (CAS 302549-25-3), with molecular formula C12H8BrN3O2S and molecular weight 336.95 g/mol. IUPAC: 5-(5-bromo-2-hydroxy-1-methylindol-3-yl)-2-sulfanylideneimidazol-4-one.
Chemical Property Profile of SDCCGSBI-0660804.P001
Property Insights of SDCCGSBI-0660804.P001
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for SDCCGSBI-0660804.P001. The TPSA of 98.7 Ų falls within the moderate polarity range, balancing permeability and solubility for SDCCGSBI-0660804.P001. Following Lipinski's Rule of Five, SDCCGSBI-0660804.P001 has 2 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 SDCCGSBI-0660804.P001?
The CAS number of SDCCGSBI-0660804.P001 is 302549-25-3.
What is the molecular formula of SDCCGSBI-0660804.P001?
The molecular formula of SDCCGSBI-0660804.P001 is C12H8BrN3O2S.
What is the molecular weight of SDCCGSBI-0660804.P001?
The molecular weight of SDCCGSBI-0660804.P001 is 336.95 g/mol.
Where can I buy SDCCGSBI-0660804.P001?
You can request a quote for SDCCGSBI-0660804.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SDCCGSBI-0660804.P001?
Yes, KEHONG BIO provides custom synthesis services for SDCCGSBI-0660804.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.