(1S,9S)-N-[(2S)-1-(4-ethoxyanilino)-1-oxo-3-phenylpropan-2-yl]-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide
-
![(1S,9S)-N-[(2S)-1-(4-ethoxyanilino)-1-oxo-3-phenylpropan-2-yl]-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/63eec6e942be4edf8b204ecb6094e202.png "(1S,9S)-N-[(2S)-1-(4-ethoxyanilino)-1-oxo-3-phenylpropan-2-yl]-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide")
(1S,9S)-N-[(2S)-1-(4-ethoxyanilino)-1-oxo-3-phenylpropan-2-yl]-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide
structure -
-
CAS No:
957028-68-1
-
Formula:
C29H32N4O4
-
Chemical Name:
(1S,9S)-N-[(2S)-1-(4-ethoxyanilino)-1-oxo-3-phenylpropan-2-yl]-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide
-
Synonyms:
ZINC2150732;STL540601;AKOS030497093;(1R,5R)-N-((S)-1-((4-ethoxyphenyl)amino)-1-oxo-3-phenylpropan-2-yl)-8-oxo-4,5,6,8-tetrahydro-1H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(2H)-carboxamide;(1S,5S)-N-{(2S)-1-[(4-ethoxyphenyl)amino]-1-oxo-3-phenylpropan-2-yl}-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide;957028-68-1
-
CAS No:
(1S,9S)-N-[(2S)-1-(4-ethoxyanilino)-1-oxo-3-phenylpropan-2-yl]-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide Basic Attributes
500.6 g/mol
500.24235551 g/mol
Computed Properties
Molecular Weight:500.6
XLogP3:3.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:500.24235551
Monoisotopic Mass:500.24235551
Topological Polar Surface Area:91
Heavy Atom Count:37
Complexity:904
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Request for Quotation