methyl 4-(hept-5-ynamido)benzoate
Chemical Structure Depiction of
methyl 4-(hept-5-ynamido)benzoate
methyl 4-(hept-5-ynamido)benzoate
Compound characteristics
| Compound ID: | 5262-0048 |
| Compound Name: | methyl 4-(hept-5-ynamido)benzoate |
| Molecular Weight: | 259.3 |
| Molecular Formula: | C15 H17 N O3 |
| Smiles: | CC#CCCCC(Nc1ccc(cc1)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5673 |
| logD: | 2.5672 |
| logSw: | -2.9294 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.562 |
| InChI Key: | MFLUTVNNFZXDDL-UHFFFAOYSA-N |