385383-38-0
Product Name:
2-(3-CHLOROPROPYL)-3-(4-METHOXYPHENYL)-1-OXO-1,2,3,4-TETRAHYDRO-4-ISOQUINOLINECARBOXYLIC ACID
Formula:
C20H20ClNO4
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COMPUTED DESCRIPTORS
| Molecular Weight | 373.8 g/mol |
|---|---|
| XLogP3 | 3.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 6 |
| Exact Mass | 373.1080858 g/mol |
| Monoisotopic Mass | 373.1080858 g/mol |
| Topological Polar Surface Area | 66.8 Ų |
| Heavy Atom Count | 26 |
| Formal Charge | 0 |
| Complexity | 506 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |