N-(4-nitrophenyl)-N'-[(2,3,4,9-tetrahydro-1H-carbazol-6-yl)methyl]thiourea
Chemical Structure Depiction of
N-(4-nitrophenyl)-N'-[(2,3,4,9-tetrahydro-1H-carbazol-6-yl)methyl]thiourea
N-(4-nitrophenyl)-N'-[(2,3,4,9-tetrahydro-1H-carbazol-6-yl)methyl]thiourea
Compound characteristics
| Compound ID: | C545-0456 |
| Compound Name: | N-(4-nitrophenyl)-N'-[(2,3,4,9-tetrahydro-1H-carbazol-6-yl)methyl]thiourea |
| Molecular Weight: | 380.47 |
| Molecular Formula: | C20 H20 N4 O2 S |
| Smiles: | C1CCc2c(C1)c1cc(CNC(Nc3ccc(cc3)[N+]([O-])=O)=S)ccc1[nH]2 |
| Stereo: | ACHIRAL |
| logP: | 3.8026 |
| logD: | 3.8026 |
| logSw: | -4.3033 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 64.535 |
| InChI Key: | NPUAPGTYRNWFCB-UHFFFAOYSA-N |