dimethyl 1-(4-methoxyphenyl)-8-methyl-9-phenyl-4,6-dithia-1,2,9-triazaspiro[4.4]nona-2,7-diene-3,7-dicarboxylate
Chemical Structure Depiction of
dimethyl 1-(4-methoxyphenyl)-8-methyl-9-phenyl-4,6-dithia-1,2,9-triazaspiro[4.4]nona-2,7-diene-3,7-dicarboxylate
dimethyl 1-(4-methoxyphenyl)-8-methyl-9-phenyl-4,6-dithia-1,2,9-triazaspiro[4.4]nona-2,7-diene-3,7-dicarboxylate
Compound characteristics
| Compound ID: | D040-0432 |
| Compound Name: | dimethyl 1-(4-methoxyphenyl)-8-methyl-9-phenyl-4,6-dithia-1,2,9-triazaspiro[4.4]nona-2,7-diene-3,7-dicarboxylate |
| Molecular Weight: | 471.55 |
| Molecular Formula: | C22 H21 N3 O5 S2 |
| Smiles: | CC1=C(C(=O)OC)SC2(N1c1ccccc1)N(c1ccc(cc1)OC)N=C(C(=O)OC)S2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3434 |
| logD: | 4.3434 |
| logSw: | -4.3792 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 65.348 |
| InChI Key: | YQNPIEBBJCHONI-QFIPXVFZSA-N |