1-oxo-N-[3-(2-oxopropyl)-1,2,4-thiadiazol-5-yl]-3,4-dihydro-1H-2-benzopyran-3-carboxamide
Chemical Structure Depiction of
1-oxo-N-[3-(2-oxopropyl)-1,2,4-thiadiazol-5-yl]-3,4-dihydro-1H-2-benzopyran-3-carboxamide
1-oxo-N-[3-(2-oxopropyl)-1,2,4-thiadiazol-5-yl]-3,4-dihydro-1H-2-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 8016-9498 |
| Compound Name: | 1-oxo-N-[3-(2-oxopropyl)-1,2,4-thiadiazol-5-yl]-3,4-dihydro-1H-2-benzopyran-3-carboxamide |
| Molecular Weight: | 331.35 |
| Molecular Formula: | C15 H13 N3 O4 S |
| Smiles: | CC(Cc1nc(NC(C2Cc3ccccc3C(=O)O2)=O)sn1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7462 |
| logD: | 1.6758 |
| logSw: | -2.7064 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.339 |
| InChI Key: | XBACPTJGMHABPV-NSHDSACASA-N |