MLS000086617

N-(5-methyl-1,2-oxazol-3-yl)-2-[[4-oxo-3-[3-(trifluoromethyl)phenyl]-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetamide

Also Known As: F0580-0979|N-(5-methyl-1,2-oxazol-3-yl)-2-({4-oxo-3-[3-(trifluoromethyl)phenyl]-3H,4H,5H-pyrimido[5,4-b]indol-2-yl}sulfanyl)acetamide|N-(5-methyl-1,2-oxazol-3-yl)-2-[[4-oxo-3-[3-(trifluoromethyl)phenyl]-5H-pyrimido[5,4-b]indol-2-yl]sulfanyl]acetamide|N-(5-methylisoxazol-3-yl)-2-((4-oxo-3-(3-(trifluoromethyl)phenyl)-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)thio)acetamide|N-(5-methyl-3-isoxazolyl){1-oxo-2-[m-(trifluoromethyl)phenyl]-2,4,9-triaza-2,9-dihydro-1H-fluoren-3-ylthio}acetamide

Molecular Formula	C23H16F3N5O3S
Molecular Weight	499.0926 g/mol
LogP	4.91302
Topological Polar Surface Area	105.81 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	5
Exact Mass	499.0926
Monoisotopic Mass	499.0926
Heavy Atoms	35
Complexity	1637.2906

Chemical Identifiers

CAS Number	536716-06-0
SMILES	CC1=CC(=NO1)NC(=O)CSC2=NC3=C(C(=O)N2C4=CC=CC(=C4)C(F)(F)F)NC5=CC=CC=C53