6-(2-ethyl-6-methyl-2,3-dihydro-4H-1,4-benzoxazine-4-sulfonyl)-2,3,4,9-tetrahydro-1H-carbazole
Chemical Structure Depiction of
6-(2-ethyl-6-methyl-2,3-dihydro-4H-1,4-benzoxazine-4-sulfonyl)-2,3,4,9-tetrahydro-1H-carbazole
6-(2-ethyl-6-methyl-2,3-dihydro-4H-1,4-benzoxazine-4-sulfonyl)-2,3,4,9-tetrahydro-1H-carbazole
Compound characteristics
| Compound ID: | K906-4618 |
| Compound Name: | 6-(2-ethyl-6-methyl-2,3-dihydro-4H-1,4-benzoxazine-4-sulfonyl)-2,3,4,9-tetrahydro-1H-carbazole |
| Molecular Weight: | 410.53 |
| Molecular Formula: | C23 H26 N2 O3 S |
| Smiles: | CCC1CN(c2cc(C)ccc2O1)S(c1ccc2c(c1)c1CCCCc1[nH]2)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6452 |
| logD: | 4.6452 |
| logSw: | -4.4596 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.404 |
| InChI Key: | BRUCDBKPQAECRN-MRXNPFEDSA-N |