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N-[4-chloro-3-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]phenyl]butanamide
N-[4-chloro-3-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]phenyl]butanamide
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![N-[4-chloro-3-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]phenyl]butanamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/198ca764f5054a64a4eed38182eb96ad.png "N-[4-chloro-3-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]phenyl]butanamide")
N-[4-chloro-3-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]phenyl]butanamide
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CAS No:
639053-87-5
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Formula:
C20H20ClN3O2S
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Chemical Name:
N-[4-chloro-3-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]phenyl]butanamide
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Synonyms:
ZINC2212895;STK234307;AKOS000467787;N-[4-chloro-3-({[(2E)-3-phenylprop-2-enoyl]carbamothioyl}amino)phenyl]butanamide;639053-87-5
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CAS No:
N-[4-chloro-3-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]phenyl]butanamide Basic Attributes
401.9 g/mol
401.0964758 g/mol
Computed Properties
Molecular Weight:401.9
XLogP3:4.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:401.0964758
Monoisotopic Mass:401.0964758
Topological Polar Surface Area:102
Heavy Atom Count:27
Complexity:549
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of N-[4-chloro-3-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]phenyl]butanamide
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