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10588-99-5 | 2-(methylsulfanyl)-10-[2-(piperidin-3-yl)ethyl]-10h-phenothiazine
CAS No: 10588-99-5 Catalog No: AG0084YG MDL No:
Product Description
Catalog Number:
AG0084YG
Chemical Name:
2-(methylsulfanyl)-10-[2-(piperidin-3-yl)ethyl]-10h-phenothiazine
CAS Number:
10588-99-5
Molecular Formula:
C20H24N2S2
Molecular Weight:
356.5480
IUPAC Name:
2-methylsulfanyl-10-(2-piperidin-3-ylethyl)phenothiazine
InChI:
InChI=1S/C20H24N2S2/c1-23-16-8-9-20-18(13-16)22(12-10-15-5-4-11-21-14-15)17-6-2-3-7-19(17)24-20/h2-3,6-9,13,15,21H,4-5,10-12,14H2,1H3
InChI Key:
SXOYTTUKVFYFPB-UHFFFAOYSA-N
SMILES:
CSc1ccc2c(c1)N(CCC1CCCNC1)c1c(S2)cccc1
Properties
Complexity:
405
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
356.138g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
356.546g/mol
Monoisotopic Mass:
356.138g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
65.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4
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