5'-bromo-1'-ethyl-5-methyl-7-propylspiro[1,3-diazatricyclo[3.3.1.1~3,7~]decane-2,3'-indole]-2',6(1'H)-dione
Chemical Structure Depiction of
5'-bromo-1'-ethyl-5-methyl-7-propylspiro[1,3-diazatricyclo[3.3.1.1~3,7~]decane-2,3'-indole]-2',6(1'H)-dione
5'-bromo-1'-ethyl-5-methyl-7-propylspiro[1,3-diazatricyclo[3.3.1.1~3,7~]decane-2,3'-indole]-2',6(1'H)-dione
Compound characteristics
Compound ID: | D171-0127 |
Compound Name: | 5'-bromo-1'-ethyl-5-methyl-7-propylspiro[1,3-diazatricyclo[3.3.1.1~3,7~]decane-2,3'-indole]-2',6(1'H)-dione |
Molecular Weight: | 432.36 |
Molecular Formula: | C21 H26 Br N3 O2 |
Smiles: | CCCC12CN3CC(C)(CN(C1)C31C(N(CC)c3ccc(cc13)[Br])=O)C2=O |
Stereo: | ACHIRAL |
logP: | 4.3428 |
logD: | 4.3428 |
logSw: | -4.3865 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 34.251 |
InChI Key: | HYRGYIGDXBFPCG-UHFFFAOYSA-N |