NSC249281

tert-butyl N-[1-[(1-hydrazinyl-4-methylsulfanyl-1-oxobutan-2-yl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate

Also Known As: tert-butyl N-[1-[(1-hydrazinyl-4-methylsulfanyl-1-oxobutan-2-yl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate|[1-(1-Hydrazinocarbonyl-3-methylsulfanyl-propylcarbamoyl)-2-(1H-indol-3-yl)-ethyl]-carbamic acid tert-butyl ester|tert-Butyl [1-{[1-hydrazinyl-4-(methylsulfanyl)-1-oxobutan-2-yl]amino}-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate|tert-butyl N-[2-[[1-(hydrazinecarbonyl)-3-methylsulfanyl-propyl]amino]-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]carbamate

Molecular Formula	C21H31N5O4S
Molecular Weight	449.2097 g/mol
LogP	1.4
Topological Polar Surface Area	164.0 Ų
Hydrogen Bond Donors	5
Hydrogen Bond Acceptors	6
Rotatable Bonds	11
Exact Mass	449.2097
Monoisotopic Mass	449.2097
Heavy Atoms	31
Complexity	627.0

Chemical Identifiers

CAS Number	5262-01-1
SMILES	CC(C)(C)OC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)NC(CCSC)C(=O)NN
InChIKey	KJUJYAAERUTXTH-UHFFFAOYSA-N