CDS1_004153
TL;DR: CDS1_004153 (CAS 332406-91-4) is a chemical compound with molecular formula C14H10BrNO3S2 and molecular weight 382.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-5-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: CDS1_004153, BAS 00449652, BIM-0023699.P001, AB00087717-01, (5E)-5-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-4-one
| Molecular Formula | C14H10BrNO3S2 |
|---|---|
| Molecular Weight | 382.93 g/mol |
| LogP | 3.565 |
| Topological Polar Surface Area | 38.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 382.92856 |
| Heavy Atoms | 21 |
| Complexity | 687.0419 |
Chemical Identifiers
| CAS Number | 332406-91-4 |
|---|---|
| SMILES | C=CCN1C(=O)/C(=C\C2=CC3=C(C=C2Br)OCO3)/SC1=S |
Product Overview
CDS1_004153 (CAS 332406-91-4), with molecular formula C14H10BrNO3S2 and molecular weight 382.93 g/mol. IUPAC: (5E)-5-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of CDS1_004153
Property Insights of CDS1_004153
The XLogP value of 3.565 indicates that CDS1_004153 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.77 Ų, CDS1_004153 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CDS1_004153 has 0 hydrogen bond donor(s) and 5 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 CDS1_004153?
The CAS number of CDS1_004153 is 332406-91-4.
What is the molecular formula of CDS1_004153?
The molecular formula of CDS1_004153 is C14H10BrNO3S2.
What is the molecular weight of CDS1_004153?
The molecular weight of CDS1_004153 is 382.93 g/mol.
Where can I buy CDS1_004153?
You can request a quote for CDS1_004153 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CDS1_004153?
Yes, KEHONG BIO provides custom synthesis services for CDS1_004153 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.