733030-55-2
Product Name:
2-(CHLOROMETHYL)-N,N-DIETHYL-5-METHYL-4-OXO-3,4-DIHYDROTHIENO[2,3-D]PYRIMIDINE-6-CARBOXAMIDE
Formula:
C13H16ClN3O2S
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 313.80 g/mol |
---|---|
XLogP3 | 2.2 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 4 |
Exact Mass | 313.0651756 g/mol |
Monoisotopic Mass | 313.0651756 g/mol |
Topological Polar Surface Area | 90 Ų |
Heavy Atom Count | 20 |
Formal Charge | 0 |
Complexity | 439 |
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 |