929972-57-6
Product Name:
2-CHLORO-5-(6,7,8,9-TETRAHYDRO-5H-[1,2,4]TRIAZOLO[4,3-A]AZEPIN-3-YL)ANILINE
Formula:
C13H15ClN4
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 262.74 g/mol |
---|---|
XLogP3 | 2.1 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 1 |
Exact Mass | 262.0985242 g/mol |
Monoisotopic Mass | 262.0985242 g/mol |
Topological Polar Surface Area | 56.7 Ų |
Heavy Atom Count | 18 |
Formal Charge | 0 |
Complexity | 288 |
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 |