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88324-39-4 | Hydrazinecarbothioamide, N,N-dimethyl-2-[1-(2-quinolinyl)ethyl]-
CAS No: 88324-39-4 Catalog No: AG0089TL MDL No:
Product Description
Catalog Number:
AG0089TL
Chemical Name:
Hydrazinecarbothioamide, N,N-dimethyl-2-[1-(2-quinolinyl)ethyl]-
CAS Number:
88324-39-4
Molecular Formula:
C14H18N4S
Molecular Weight:
274.3845
IUPAC Name:
1,1-dimethyl-3-(1-quinolin-2-ylethylamino)thiourea
InChI:
InChI=1S/C14H18N4S/c1-10(16-17-14(19)18(2)3)12-9-8-11-6-4-5-7-13(11)15-12/h4-10,16H,1-3H3,(H,17,19)
InChI Key:
HEMLPVJIOAYTPW-UHFFFAOYSA-N
SMILES:
S=C(N(C)C)NNC(c1ccc2c(n1)cccc2)C
Properties
Complexity:
308
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.125g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
274.386g/mol
Monoisotopic Mass:
274.125g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
72.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Literature
| Title | Journal |
|---|---|
| Thiosemicarbazones of 2-acetylpyridine, 2-acetylquinoline, 1-acetylisoquinoline, and related compounds as inhibitors of herpes simplex virus in vitro and in a cutaneous herpes guinea pig model. | Antiviral research 19860701 |
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