32262-47-8
Product Name:
2-Thioxo-3-(2,6-xylyl)-2,3,4,5-tetrahydro-1H-1,3-diazepin-4-one
Formula:
C13H16N2OS
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 246.33 g/mol |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 1 |
| Exact Mass | 246.08268425 g/mol |
| Monoisotopic Mass | 246.08268425 g/mol |
| Topological Polar Surface Area | 64.4 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 343 |
| 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 |