164366-30-7
Product Name:
4-OXO-4,6,7,8,9,10-HEXAHYDRO-PYRIDO[1,2-A]AZEPINE-1-CARBOXYLIC ACID ETHYL ESTER
Formula:
C13H17NO3
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 235.28 g/mol |
|---|---|
| XLogP3 | 1.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 235.12084340 g/mol |
| Monoisotopic Mass | 235.12084340 g/mol |
| Topological Polar Surface Area | 46.6 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 396 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |