3-(1-acetyl-5-bromo-2-methyl-2,3-dihydro-1H-indole-6-sulfonyl)-1-(3,4-dihydroisoquinolin-2(1H)-yl)propan-1-one
Chemical Structure Depiction of
3-(1-acetyl-5-bromo-2-methyl-2,3-dihydro-1H-indole-6-sulfonyl)-1-(3,4-dihydroisoquinolin-2(1H)-yl)propan-1-one
3-(1-acetyl-5-bromo-2-methyl-2,3-dihydro-1H-indole-6-sulfonyl)-1-(3,4-dihydroisoquinolin-2(1H)-yl)propan-1-one
Compound characteristics
| Compound ID: | C287-0304 |
| Compound Name: | 3-(1-acetyl-5-bromo-2-methyl-2,3-dihydro-1H-indole-6-sulfonyl)-1-(3,4-dihydroisoquinolin-2(1H)-yl)propan-1-one |
| Molecular Weight: | 505.43 |
| Molecular Formula: | C23 H25 Br N2 O4 S |
| Smiles: | CC1Cc2cc(c(cc2N1C(C)=O)S(CCC(N1CCc2ccccc2C1)=O)(=O)=O)[Br] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0886 |
| logD: | 3.0886 |
| logSw: | -3.5171 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.415 |
| InChI Key: | IQFRSOSSSHAAMB-OAHLLOKOSA-N |