(1-{[(2S)-4,4-difluoro-1-(1H-indole-5-carbonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)(morpholin-4-yl)methanone
Chemical Structure Depiction of
(1-{[(2S)-4,4-difluoro-1-(1H-indole-5-carbonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)(morpholin-4-yl)methanone
(1-{[(2S)-4,4-difluoro-1-(1H-indole-5-carbonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)(morpholin-4-yl)methanone
Compound characteristics
| Compound ID: | SB36-0605 |
| Compound Name: | (1-{[(2S)-4,4-difluoro-1-(1H-indole-5-carbonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)(morpholin-4-yl)methanone |
| Molecular Weight: | 444.44 |
| Molecular Formula: | C21 H22 F2 N6 O3 |
| Smiles: | C1[C@@H](Cn2cc(C(N3CCOCC3)=O)nn2)N(CC1(F)F)C(c1ccc2c(cc[nH]2)c1)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.9051 |
| logD: | 0.9051 |
| logSw: | -2.1268 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.684 |
| InChI Key: | MKQPSQPYXDZRFL-MRXNPFEDSA-N |