N,N-dimethyl-2-({4-[(3-methylbutyl)carbamoyl]piperazin-1-yl}methyl)-1,3-benzoxazole-5-carboxamide
Chemical Structure Depiction of
N,N-dimethyl-2-({4-[(3-methylbutyl)carbamoyl]piperazin-1-yl}methyl)-1,3-benzoxazole-5-carboxamide
N,N-dimethyl-2-({4-[(3-methylbutyl)carbamoyl]piperazin-1-yl}methyl)-1,3-benzoxazole-5-carboxamide
Compound characteristics
| Compound ID: | L407-0255 |
| Compound Name: | N,N-dimethyl-2-({4-[(3-methylbutyl)carbamoyl]piperazin-1-yl}methyl)-1,3-benzoxazole-5-carboxamide |
| Molecular Weight: | 401.51 |
| Molecular Formula: | C21 H31 N5 O3 |
| Smiles: | CC(C)CCNC(N1CCN(CC1)Cc1nc2cc(ccc2o1)C(N(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5164 |
| logD: | 1.4931 |
| logSw: | -2.2987 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.431 |
| InChI Key: | DKAKCADRGAQITI-UHFFFAOYSA-N |