6-chloro-3-[4-(prop-2-en-1-yl)piperazine-1-carbonyl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-chloro-3-[4-(prop-2-en-1-yl)piperazine-1-carbonyl]-2H-1-benzopyran-2-one
6-chloro-3-[4-(prop-2-en-1-yl)piperazine-1-carbonyl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y200-6412 |
| Compound Name: | 6-chloro-3-[4-(prop-2-en-1-yl)piperazine-1-carbonyl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 332.78 |
| Molecular Formula: | C17 H17 Cl N2 O3 |
| Smiles: | C=CCN1CCN(CC1)C(C1=Cc2cc(ccc2OC1=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.1192 |
| logD: | 2.0649 |
| logSw: | -3.1048 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.599 |
| InChI Key: | MULPMJMQHLEGRY-UHFFFAOYSA-N |