Home Other Building Blocks N,N-dimethyl-1-[(1-methyl-1H-pyrazol-4-yl)sulfanyl]formamide

N,N-dimethyl-1-[(1-methyl-1H-pyrazol-4-yl)sulfanyl]formamide

CAS No.:
2137858-72-9
Catalog Number:
AG01EINL
Molecular Formula:
C7H11N3OS
Molecular Weight:
185.2467
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Product Description
Catalog Number:
AG01EINL
Chemical Name:
N,N-dimethyl-1-[(1-methyl-1H-pyrazol-4-yl)sulfanyl]formamide
CAS Number:
2137858-72-9
Molecular Formula:
C7H11N3OS
Molecular Weight:
185.2467
MDL Number:
MFCD31421867
IUPAC Name:
S-(1-methylpyrazol-4-yl) N,N-dimethylcarbamothioate
InChI:
InChI=1S/C7H11N3OS/c1-9(2)7(11)12-6-4-8-10(3)5-6/h4-5H,1-3H3
InChI Key:
YUXDBQIYWQFSPT-UHFFFAOYSA-N
SMILES:
O=C(N(C)C)Sc1cnn(c1)C
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.062g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
185.245g/mol
Monoisotopic Mass:
185.062g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
63.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties