2-[(2,3-Dichlorophenyl)amino]-1-methyl-2-oxoethyl 3-(2-thiazolyl)-2-propenoate
Basic information
- CAS
1181472-00-3- Standard SMILES
CC(OC(=O)C=Cc1nccs1)C(=O)Nc1cccc(Cl)c1Cl- InChIKey
YLJBDKMRJNHSII-UHFFFAOYSA-N- Molecular formula
- C15H12Cl2N2O3S
- Average molar mass
- 371.2 g/mol
- Monoisotopic mass
- 369.9945688
Names & identifiers
- Preferred name
- 2-[(2,3-Dichlorophenyl)amino]-1-methyl-2-oxoethyl 3-(2-thiazolyl)-2-propenoate
- IUPAC
- [1-(2,3-dichloroanilino)-1-oxopropan-2-yl] 3-(1,3-thiazol-2-yl)prop-2-enoate
Names & synonyms
2-[(2,3-Dichlorophenyl)amino]-1-methyl-2-oxoethyl 3-(2-thiazolyl)-2-propenoate1181472-00-3DTXSID401136892AKOS0344809531-(2,3-Dichloroanilino)-1-oxopropan-2-yl 3-(1,3-thiazol-2-yl)prop-2-enoate
Database identifiers
- CAS
1181472-00-3- PubChem CID
- 72049779
- DTXSID
DTXSID401136892
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 96.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 464
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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