3-(1-acetyl-2,3-dihydro-1H-indole-5-sulfonyl)-1-(3-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)propan-1-one
Chemical Structure Depiction of
3-(1-acetyl-2,3-dihydro-1H-indole-5-sulfonyl)-1-(3-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)propan-1-one
3-(1-acetyl-2,3-dihydro-1H-indole-5-sulfonyl)-1-(3-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)propan-1-one
Compound characteristics
| Compound ID: | T501-1324 |
| Compound Name: | 3-(1-acetyl-2,3-dihydro-1H-indole-5-sulfonyl)-1-(3-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)propan-1-one |
| Molecular Weight: | 499.63 |
| Molecular Formula: | C25 H33 N5 O4 S |
| Smiles: | CC(N1CCc2cc(ccc12)S(CCC(N1CCCC(Cc2nncn2CC2CC2)C1)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.9988 |
| logD: | 0.9988 |
| logSw: | -2.4032 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 87.331 |
| InChI Key: | NJFTZOQABWIMOW-HXUWFJFHSA-N |