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63285-55-2 | 2-(1H-Pyrazol-3-yl)-10H-phenothiazine
CAS No: 63285-55-2 Catalog No: AG003EPE MDL No:MFCD08056669
Product Description
Catalog Number:
AG003EPE
Chemical Name:
2-(1H-Pyrazol-3-yl)-10H-phenothiazine
CAS Number:
63285-55-2
Molecular Formula:
C15H11N3S
Molecular Weight:
265.3329
MDL Number:
MFCD08056669
IUPAC Name:
2-(1H-pyrazol-5-yl)-10H-phenothiazine
InChI:
InChI=1S/C15H11N3S/c1-2-4-14-12(3-1)17-13-9-10(5-6-15(13)19-14)11-7-8-16-18-11/h1-9,17H,(H,16,18)
InChI Key:
FNWWCIGZVBAOTH-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)Sc1c(N2)cc(cc1)c1cc[nH]n1
Properties
Complexity:
325
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.067g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
265.334g/mol
Monoisotopic Mass:
265.067g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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