1,3-bis(methylsulfanyl)-1-sulfanylidene-1,5,6,7-tetrahydro-1lambda~5~-pyrrolo[1,2-c][1,3,2]diazaphosphinine-4-carbonitrile
Chemical Structure Depiction of
1,3-bis(methylsulfanyl)-1-sulfanylidene-1,5,6,7-tetrahydro-1lambda~5~-pyrrolo[1,2-c][1,3,2]diazaphosphinine-4-carbonitrile
1,3-bis(methylsulfanyl)-1-sulfanylidene-1,5,6,7-tetrahydro-1lambda~5~-pyrrolo[1,2-c][1,3,2]diazaphosphinine-4-carbonitrile
Compound characteristics
| Compound ID: | 3228-0037 |
| Compound Name: | 1,3-bis(methylsulfanyl)-1-sulfanylidene-1,5,6,7-tetrahydro-1lambda~5~-pyrrolo[1,2-c][1,3,2]diazaphosphinine-4-carbonitrile |
| Molecular Weight: | 289.38 |
| Molecular Formula: | C9 H12 N3 P S3 |
| Smiles: | CSC1C(C#N)=C2CCCN2P(N=1)(=S)SC |
| Stereo: | ACHIRAL |
| logP: | 2.1151 |
| logD: | 2.1151 |
| logSw: | -1.8944 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 28.3842 |
| InChI Key: | JRFHTVQMDCFEFL-ZDUSSCGKSA-N |