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160199-05-3 | [1]Benzothieno[3,2-d]pyrimidine, 2,4-dichloro-
CAS No: 160199-05-3 Catalog No: AG001RR3 MDL No:
Product Description
Catalog Number:
AG001RR3
Chemical Name:
[1]Benzothieno[3,2-d]pyrimidine, 2,4-dichloro-
CAS Number:
160199-05-3
Molecular Formula:
C10H4Cl2N2S
Molecular Weight:
255.1232
IUPAC Name:
2,4-dichloro-[1]benzothiolo[3,2-d]pyrimidine
InChI:
InChI=1S/C10H4Cl2N2S/c11-9-8-7(13-10(12)14-9)5-3-1-2-4-6(5)15-8/h1-4H
InChI Key:
BSWVSKQCYPFXJF-UHFFFAOYSA-N
SMILES:
Clc1nc(Cl)c2c(n1)c1ccccc1s2
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.947g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
255.116g/mol
Monoisotopic Mass:
253.947g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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