1,1'-[1-(4-methoxyphenyl)-8,9-dimethyl-4,6-dithia-1,2,9-triazaspiro[4.4]nona-2,7-diene-3,7-diyl]di(ethan-1-one)
Chemical Structure Depiction of
1,1'-[1-(4-methoxyphenyl)-8,9-dimethyl-4,6-dithia-1,2,9-triazaspiro[4.4]nona-2,7-diene-3,7-diyl]di(ethan-1-one)
1,1'-[1-(4-methoxyphenyl)-8,9-dimethyl-4,6-dithia-1,2,9-triazaspiro[4.4]nona-2,7-diene-3,7-diyl]di(ethan-1-one)
Compound characteristics
| Compound ID: | D040-0004 |
| Compound Name: | 1,1'-[1-(4-methoxyphenyl)-8,9-dimethyl-4,6-dithia-1,2,9-triazaspiro[4.4]nona-2,7-diene-3,7-diyl]di(ethan-1-one) |
| Molecular Weight: | 377.48 |
| Molecular Formula: | C17 H19 N3 O3 S2 |
| Smiles: | CC1=C(C(C)=O)SC2(N1C)N(c1ccc(cc1)OC)N=C(C(C)=O)S2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7422 |
| logD: | 2.7422 |
| logSw: | -3.0746 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 51.302 |
| InChI Key: | WOUVAUOIIRIVNK-KRWDZBQOSA-N |