4-{[2-(diethylamino)ethyl]amino}-3-nitro-2H-1-benzopyran-2-one
Chemical Structure Depiction of
4-{[2-(diethylamino)ethyl]amino}-3-nitro-2H-1-benzopyran-2-one
4-{[2-(diethylamino)ethyl]amino}-3-nitro-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 0266-0176 |
| Compound Name: | 4-{[2-(diethylamino)ethyl]amino}-3-nitro-2H-1-benzopyran-2-one |
| Molecular Weight: | 305.33 |
| Molecular Formula: | C15 H19 N3 O4 |
| Smiles: | CCN(CC)CCNC1=C(C(=O)Oc2ccccc12)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.8698 |
| logD: | 1.8698 |
| logSw: | -2.6548 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.418 |
| InChI Key: | RRABXLZGCDIZFJ-UHFFFAOYSA-N |