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883008-24-0 | tert-Butyl (2-(2-(cyclopropylcarbamothioyl)hydrazinyl)-2-oxoethyl)carbamate
CAS No: 883008-24-0 Catalog No: AG0048QX MDL No:MFCD01764057
Product Description
Catalog Number:
AG0048QX
Chemical Name:
tert-Butyl (2-(2-(cyclopropylcarbamothioyl)hydrazinyl)-2-oxoethyl)carbamate
CAS Number:
883008-24-0
Molecular Formula:
C11H20N4O3S
Molecular Weight:
288.3665
MDL Number:
MFCD01764057
IUPAC Name:
tert-butyl N-[2-[2-(cyclopropylcarbamothioyl)hydrazinyl]-2-oxoethyl]carbamate
InChI:
InChI=1S/C11H20N4O3S/c1-11(2,3)18-10(17)12-6-8(16)14-15-9(19)13-7-4-5-7/h7H,4-6H2,1-3H3,(H,12,17)(H,14,16)(H2,13,15,19)
InChI Key:
JTOOTOXSYMNSQX-UHFFFAOYSA-N
SMILES:
O=C(NNC(=S)NC1CC1)CNC(=O)OC(C)(C)C
Properties
Complexity:
363
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.126g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
288.366g/mol
Monoisotopic Mass:
288.126g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
124A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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