C19H12ClNO3S2
TL;DR: C19H12ClNO3S2 (CAS 331948-75-5) is a chemical compound with molecular formula C19H12ClNO3S2 and molecular weight 400.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-5-[[5-(4-chlorophenyl)furan-2-yl]methylidene]-3-(furan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: BAS 00474123, (5E)-5-[[5-(4-chlorophenyl)furan-2-yl]methylidene]-3-(furan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one, (E)-5-((5-(4-chlorophenyl)furan-2-yl)methylene)-3-(furan-2-ylmethyl)-2-thioxothiazolidin-4-one, 5-((5-(4-CL-PH)-2-FURYL)METHYLENE)-3-(2-FURYL-ME)-2-THIOXO-1,3-THIAZOLIDIN-4-ONE, 5-{[5-(4-chlorophenyl)(2-furyl)]methylene}-3-(2-furylmethyl)-2-thioxo-1,3-thia zolidin-4-one
| Molecular Formula | C19H12ClNO3S2 |
|---|---|
| Molecular Weight | 400.99 g/mol |
| LogP | 5.5944 |
| Topological Polar Surface Area | 46.59 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 400.99472 |
| Heavy Atoms | 26 |
| Complexity | 990.2329 |
Chemical Identifiers
| CAS Number | 331948-75-5 |
|---|---|
| SMILES | C1=COC(=C1)CN2C(=O)/C(=C\C3=CC=C(O3)C4=CC=C(C=C4)Cl)/SC2=S |
Product Overview
C19H12ClNO3S2 (CAS 331948-75-5), with molecular formula C19H12ClNO3S2 and molecular weight 400.99 g/mol. IUPAC: (5E)-5-[[5-(4-chlorophenyl)furan-2-yl]methylidene]-3-(furan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of C19H12ClNO3S2
Property Insights of C19H12ClNO3S2
The XLogP value of 5.5944 indicates that C19H12ClNO3S2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.59 Ų, C19H12ClNO3S2 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C19H12ClNO3S2 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C19H12ClNO3S2?
The CAS number of C19H12ClNO3S2 is 331948-75-5.
What is the molecular formula of C19H12ClNO3S2?
The molecular formula of C19H12ClNO3S2 is C19H12ClNO3S2.
What is the molecular weight of C19H12ClNO3S2?
The molecular weight of C19H12ClNO3S2 is 400.99 g/mol.
Where can I buy C19H12ClNO3S2?
You can request a quote for C19H12ClNO3S2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C19H12ClNO3S2?
Yes, KEHONG BIO provides custom synthesis services for C19H12ClNO3S2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.