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1870587-33-9 | 6-(2,5-dihydro-1H-pyrrol-1-yl)imidazo[2,1-b][1,3]thiazole-5-carbaldehyde
CAS No: 1870587-33-9 Catalog No: AG01C8SM MDL No:
Product Description
Catalog Number:
AG01C8SM
Chemical Name:
6-(2,5-dihydro-1H-pyrrol-1-yl)imidazo[2,1-b][1,3]thiazole-5-carbaldehyde
CAS Number:
1870587-33-9
Molecular Formula:
C10H9N3OS
Molecular Weight:
219.2630
IUPAC Name:
6-(2,5-dihydropyrrol-1-yl)imidazo[2,1-b][1,3]thiazole-5-carbaldehyde
InChI:
InChI=1S/C10H9N3OS/c14-7-8-9(12-3-1-2-4-12)11-10-13(8)5-6-15-10/h1-2,5-7H,3-4H2
InChI Key:
KRWPKDITFINQOO-UHFFFAOYSA-N
SMILES:
O=Cc1c(nc2n1ccs2)N1CC=CC1
Properties
Complexity:
288
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.047g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.262g/mol
Monoisotopic Mass:
219.047g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
65.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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