1,1'-[1-(3-methylphenyl)-8,9-diphenyl-4-thia-1,2,6,7,9-pentaazaspiro[4.4]nona-2,7-diene-3,6-diyl]di(ethan-1-one)
Chemical Structure Depiction of
1,1'-[1-(3-methylphenyl)-8,9-diphenyl-4-thia-1,2,6,7,9-pentaazaspiro[4.4]nona-2,7-diene-3,6-diyl]di(ethan-1-one)
1,1'-[1-(3-methylphenyl)-8,9-diphenyl-4-thia-1,2,6,7,9-pentaazaspiro[4.4]nona-2,7-diene-3,6-diyl]di(ethan-1-one)
Compound characteristics
| Compound ID: | 8011-7521 |
| Compound Name: | 1,1'-[1-(3-methylphenyl)-8,9-diphenyl-4-thia-1,2,6,7,9-pentaazaspiro[4.4]nona-2,7-diene-3,6-diyl]di(ethan-1-one) |
| Molecular Weight: | 469.56 |
| Molecular Formula: | C26 H23 N5 O2 S |
| Smiles: | CC(C1=NN(c2cccc(C)c2)C2(N(C(c3ccccc3)=NN2C(C)=O)c2ccccc2)S1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8491 |
| logD: | 4.8491 |
| logSw: | -4.7265 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.042 |
| InChI Key: | PHVIIJOLDIOCMB-AREMUKBSSA-N |