4-(dibutylamino)-3-nitro-2H-1-benzopyran-2-one
Chemical Structure Depiction of
4-(dibutylamino)-3-nitro-2H-1-benzopyran-2-one
4-(dibutylamino)-3-nitro-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 1069-0005 |
| Compound Name: | 4-(dibutylamino)-3-nitro-2H-1-benzopyran-2-one |
| Molecular Weight: | 318.37 |
| Molecular Formula: | C17 H22 N2 O4 |
| Smiles: | CCCCN(CCCC)C1=C(C(=O)Oc2ccccc12)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.5081 |
| logD: | 4.5081 |
| logSw: | -4.437 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.621 |
| InChI Key: | GOKWVXKBJOGEIH-UHFFFAOYSA-N |