(E)-3-(furan-2-yl)-N-[(4-methoxyphenyl)carbamothioyl]prop-2-enamide
Basic information
- CAS
307331-04-0- Standard SMILES
COc1ccc(NC(=S)NC(=O)/C=C/c2ccco2)cc1- InChIKey
RPEALYWUDARZQV-CMDGGOBGSA-N- Molecular formula
- C15H14N2O3S
- Average molar mass
- 302.4 g/mol
- Monoisotopic mass
- 302.07251349
Names & identifiers
- Preferred name
- (E)-3-(furan-2-yl)-N-[(4-methoxyphenyl)carbamothioyl]prop-2-enamide
- IUPAC
- (E)-3-(furan-2-yl)-N-[(4-methoxyphenyl)carbamothioyl]prop-2-enamide
Names & synonyms
(2E)-3-(furan-2-yl)-N-[(4-methoxyphenyl)carbamothioyl]prop-2-enamideBAS 00227218(E)-3-(furan-2-yl)-N-[(4-methoxyphenyl)carbamothioyl]prop-2-enamide307331-04-0MLS000856460CHEMBL1491822DTXSID901328290HMS2666H21STK864291AKOS000584484SMR000279405ST50219510
Show more names
SR-01000310975SR-01000310975-1(E)-3-(furan-2-yl)-N-((4-methoxyphenyl)carbamothioyl)acrylamide3-[(2E)-3-(FURAN-2-YL)PROP-2-ENOYL]-1-(4-METHOXYPHENYL)THIOUREA
Database identifiers
- CAS
307331-04-0- PubChem CID
- 835019
- DTXSID
DTXSID901328290- ChEMBL
CHEMBL1491822
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 95.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 392
Experimental & physicochemical properties
Solubility1.2 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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