5-(8-methyl-1,2,3a,4,5,6-hexahydro-3H-pyrazino[3,2,1-jk]carbazole-3-sulfonyl)-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
5-(8-methyl-1,2,3a,4,5,6-hexahydro-3H-pyrazino[3,2,1-jk]carbazole-3-sulfonyl)-1,3-benzothiazol-2(3H)-one
5-(8-methyl-1,2,3a,4,5,6-hexahydro-3H-pyrazino[3,2,1-jk]carbazole-3-sulfonyl)-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | 8019-5821 |
| Compound Name: | 5-(8-methyl-1,2,3a,4,5,6-hexahydro-3H-pyrazino[3,2,1-jk]carbazole-3-sulfonyl)-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 439.55 |
| Molecular Formula: | C22 H21 N3 O3 S2 |
| Smiles: | Cc1ccc2c(c1)c1CCCC3c1n2CCN3S(c1ccc2c(c1)NC(=O)S2)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2039 |
| logD: | 5.2021 |
| logSw: | -5.0296 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.32 |
| InChI Key: | ZTLPUYUNDYXFCS-IBGZPJMESA-N |