5-methyl-3-pentanoyl-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
5-methyl-3-pentanoyl-1,3-benzoxazol-2(3H)-one
5-methyl-3-pentanoyl-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | G558-0108 |
| Compound Name: | 5-methyl-3-pentanoyl-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 233.26 |
| Molecular Formula: | C13 H15 N O3 |
| Smiles: | CCCCC(N1C(=O)Oc2ccc(C)cc12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6197 |
| logD: | 2.6197 |
| logSw: | -2.8643 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 35.396 |
| InChI Key: | VXDGFFQKUAXCCD-UHFFFAOYSA-N |