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1019384-02-1 | Thieno[2,3-d]pyrimidine, 4-chloro-2-cyclopropyl-5-phenyl-
CAS No: 1019384-02-1 Catalog No: AG000606 MDL No:MFCD12531439
Product Description
Catalog Number:
AG000606
Chemical Name:
Thieno[2,3-d]pyrimidine, 4-chloro-2-cyclopropyl-5-phenyl-
CAS Number:
1019384-02-1
Molecular Formula:
C15H11ClN2S
Molecular Weight:
286.7792
MDL Number:
MFCD12531439
IUPAC Name:
4-chloro-2-cyclopropyl-5-phenylthieno[2,3-d]pyrimidine
InChI:
InChI=1S/C15H11ClN2S/c16-13-12-11(9-4-2-1-3-5-9)8-19-15(12)18-14(17-13)10-6-7-10/h1-5,8,10H,6-7H2
InChI Key:
GDFQJKDEJAHULN-UHFFFAOYSA-N
SMILES:
Clc1nc(nc2c1c(cs2)c1ccccc1)C1CC1
Properties
Complexity:
330
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.033g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
286.777g/mol
Monoisotopic Mass:
286.033g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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