2-methyl-1-{4-[rel-(3R,4R)-4-(phenoxymethyl)-1-(pyrimidine-4-carbonyl)pyrrolidin-3-yl]piperidin-1-yl}propan-1-one
					Chemical Structure Depiction of
2-methyl-1-{4-[rel-(3R,4R)-4-(phenoxymethyl)-1-(pyrimidine-4-carbonyl)pyrrolidin-3-yl]piperidin-1-yl}propan-1-one
			2-methyl-1-{4-[rel-(3R,4R)-4-(phenoxymethyl)-1-(pyrimidine-4-carbonyl)pyrrolidin-3-yl]piperidin-1-yl}propan-1-one
Compound characteristics
| Compound ID: | S995-0354 | 
| Compound Name: | 2-methyl-1-{4-[rel-(3R,4R)-4-(phenoxymethyl)-1-(pyrimidine-4-carbonyl)pyrrolidin-3-yl]piperidin-1-yl}propan-1-one | 
| Molecular Weight: | 436.55 | 
| Molecular Formula: | C25 H32 N4 O3 | 
| Smiles: | CC(C)C(N1CCC(CC1)[C@@H]1CN(C[C@H]1COc1ccccc1)C(c1ccncn1)=O)=O | 
| Stereo: | RACEMIC MIXTURE (RELATIVE) | 
| logP: | 2.8708 | 
| logD: | 2.8708 | 
| logSw: | -2.9553 | 
| Hydrogen bond acceptors count: | 7 | 
| Polar surface area: | 61.186 | 
| InChI Key: | CTJJZSOLJBLGGN-UNMCSNQZSA-N | 
 
				 
				