3-(4-chlorophenyl)-8-[(4-nitrophenyl)methyl]-1,4,8-triazaspiro[4.5]dec-3-en-2-one
Chemical Structure Depiction of
3-(4-chlorophenyl)-8-[(4-nitrophenyl)methyl]-1,4,8-triazaspiro[4.5]dec-3-en-2-one
3-(4-chlorophenyl)-8-[(4-nitrophenyl)methyl]-1,4,8-triazaspiro[4.5]dec-3-en-2-one
Compound characteristics
| Compound ID: | G610-0398 |
| Compound Name: | 3-(4-chlorophenyl)-8-[(4-nitrophenyl)methyl]-1,4,8-triazaspiro[4.5]dec-3-en-2-one |
| Molecular Weight: | 398.85 |
| Molecular Formula: | C20 H19 Cl N4 O3 |
| Smiles: | C1CN(CCC12NC(C(c1ccc(cc1)[Cl])=N2)=O)Cc1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.2178 |
| logD: | 1.8303 |
| logSw: | -3.8814 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.703 |
| InChI Key: | AOCITCIKFNGMHI-UHFFFAOYSA-N |