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405298-95-5 | 10H-Phenothiazine, 10-pentyl-
CAS No: 405298-95-5 Catalog No: AG0076MK MDL No:
Product Description
Catalog Number:
AG0076MK
Chemical Name:
10H-Phenothiazine, 10-pentyl-
CAS Number:
405298-95-5
Molecular Formula:
C17H19NS
Molecular Weight:
269.4045
IUPAC Name:
10-pentylphenothiazine
InChI:
InChI=1S/C17H19NS/c1-2-3-8-13-18-14-9-4-6-11-16(14)19-17-12-7-5-10-15(17)18/h4-7,9-12H,2-3,8,13H2,1H3
InChI Key:
IYGQPCPOLJTIGO-UHFFFAOYSA-N
SMILES:
CCCCCN1c2ccccc2Sc2c1cccc2
Properties
Complexity:
258
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.124g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.406g/mol
Monoisotopic Mass:
269.124g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
28.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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