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861213-00-5 | 1,3-dimethyl-5-{[6-(4-methylphenyl)imidazo[2,1-b][1,3]thiazol-5-yl]methylidene}-1,3-diazinane-2,4,6-trione
CAS No: 861213-00-5 Catalog No: AG00IOUB MDL No:MFCD03305658
Product Description
Catalog Number:
AG00IOUB
Chemical Name:
1,3-dimethyl-5-{[6-(4-methylphenyl)imidazo[2,1-b][1,3]thiazol-5-yl]methylidene}-1,3-diazinane-2,4,6-trione
CAS Number:
861213-00-5
Molecular Formula:
C19H16N4O3S
Molecular Weight:
380.4203
MDL Number:
MFCD03305658
IUPAC Name:
1,3-dimethyl-5-[[6-(4-methylphenyl)imidazo[2,1-b][1,3]thiazol-5-yl]methylidene]-1,3-diazinane-2,4,6-trione
InChI:
InChI=1S/C19H16N4O3S/c1-11-4-6-12(7-5-11)15-14(23-8-9-27-18(23)20-15)10-13-16(24)21(2)19(26)22(3)17(13)25/h4-10H,1-3H3
InChI Key:
OIKZQAOKVOCBSQ-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)c1nc2n(c1C=C1C(=O)N(C)C(=O)N(C1=O)C)ccs2
Properties
Complexity:
662
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
380.094g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
380.422g/mol
Monoisotopic Mass:
380.094g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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