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102240-88-0 | 10H-Phenothiazine, 10-[2-(4-ethyl-1-piperazinyl)ethyl]-
CAS No: 102240-88-0 Catalog No: AG000700 MDL No:
Product Description
Catalog Number:
AG000700
Chemical Name:
10H-Phenothiazine, 10-[2-(4-ethyl-1-piperazinyl)ethyl]-
CAS Number:
102240-88-0
Molecular Formula:
C20H25N3S
Molecular Weight:
339.4976
IUPAC Name:
10-[2-(4-ethylpiperazin-1-yl)ethyl]phenothiazine
InChI:
InChI=1S/C20H25N3S/c1-2-21-11-13-22(14-12-21)15-16-23-17-7-3-5-9-19(17)24-20-10-6-4-8-18(20)23/h3-10H,2,11-16H2,1H3
InChI Key:
YMCGLCVGCYOFBT-UHFFFAOYSA-N
SMILES:
CCN1CCN(CC1)CCN1c2ccccc2Sc2c1cccc2
Properties
Complexity:
374
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
339.177g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
339.501g/mol
Monoisotopic Mass:
339.177g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
35A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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