477869-92-4
Product Name:
ETHYL 2-[2-(2,5-DIMETHYL-1H-PYRROL-1-YL)[1,2,4]TRIAZOLO[1,5-A]PYRIMIDIN-7-YL]-3-PHENYLPROPANOATE
Formula:
C22H23N5O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 389.4 g/mol |
|---|---|
| XLogP3 | 3.8 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 7 |
| Exact Mass | 389.18517499 g/mol |
| Monoisotopic Mass | 389.18517499 g/mol |
| Topological Polar Surface Area | 74.3 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 545 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |