butyl 4-[2-cyano-3-(thiophen-2-yl)prop-2-enamido]benzoate
Chemical Structure Depiction of
butyl 4-[2-cyano-3-(thiophen-2-yl)prop-2-enamido]benzoate
butyl 4-[2-cyano-3-(thiophen-2-yl)prop-2-enamido]benzoate
Compound characteristics
| Compound ID: | 3771-9097 |
| Compound Name: | butyl 4-[2-cyano-3-(thiophen-2-yl)prop-2-enamido]benzoate |
| Molecular Weight: | 354.43 |
| Molecular Formula: | C19 H18 N2 O3 S |
| Smiles: | CCCCOC(c1ccc(cc1)NC(C(=C\c1cccs1)\C#N)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6793 |
| logD: | 4.5947 |
| logSw: | -4.4201 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.452 |
| InChI Key: | QMYOJMRXHPKHJJ-UHFFFAOYSA-N |