4-(5-methylthiophen-2-yl)-3-(3-nitrophenyl)-4,5-dihydropyrano[2,3-c]pyrazol-6(1H)-one
Chemical Structure Depiction of
4-(5-methylthiophen-2-yl)-3-(3-nitrophenyl)-4,5-dihydropyrano[2,3-c]pyrazol-6(1H)-one
4-(5-methylthiophen-2-yl)-3-(3-nitrophenyl)-4,5-dihydropyrano[2,3-c]pyrazol-6(1H)-one
Compound characteristics
| Compound ID: | 8018-0190 |
| Compound Name: | 4-(5-methylthiophen-2-yl)-3-(3-nitrophenyl)-4,5-dihydropyrano[2,3-c]pyrazol-6(1H)-one |
| Molecular Weight: | 355.37 |
| Molecular Formula: | C17 H13 N3 O4 S |
| Smiles: | Cc1ccc(C2CC(=O)Oc3c2c(c2cccc(c2)[N+]([O-])=O)n[nH]3)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6997 |
| logD: | 3.6997 |
| logSw: | -4.0772 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.953 |
| InChI Key: | DNHIVKNPKWLSRD-LBPRGKRZSA-N |