3-[({2-[bis(2-methylpropyl)amino]ethyl}amino)methyl]-1-[(2-fluorophenyl)methyl]-1H-indole-2-carboxylic acid
Chemical Structure Depiction of
3-[({2-[bis(2-methylpropyl)amino]ethyl}amino)methyl]-1-[(2-fluorophenyl)methyl]-1H-indole-2-carboxylic acid
3-[({2-[bis(2-methylpropyl)amino]ethyl}amino)methyl]-1-[(2-fluorophenyl)methyl]-1H-indole-2-carboxylic acid
Compound characteristics
Compound ID: | C753-1191 |
Compound Name: | 3-[({2-[bis(2-methylpropyl)amino]ethyl}amino)methyl]-1-[(2-fluorophenyl)methyl]-1H-indole-2-carboxylic acid |
Molecular Weight: | 453.6 |
Molecular Formula: | C27 H36 F N3 O2 |
Smiles: | CC(C)CN(CCNCc1c2ccccc2n(Cc2ccccc2F)c1C(O)=O)CC(C)C |
Stereo: | ACHIRAL |
logP: | 5.4534 |
logD: | 5.4534 |
logSw: | -5.4174 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 44.717 |
InChI Key: | SNWVBVJGDFDLKA-UHFFFAOYSA-N |