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97921-94-3 | 10-(3-(4-ISOPROPYL-1-PIPERAZINYL)PROPYL)PHENOTHIAZINE
CAS No: 97921-94-3 Catalog No: AG006AKL MDL No:
Product Description
Catalog Number:
AG006AKL
Chemical Name:
10-(3-(4-ISOPROPYL-1-PIPERAZINYL)PROPYL)PHENOTHIAZINE
CAS Number:
97921-94-3
Molecular Formula:
C22H29N3S
Molecular Weight:
367.5508
IUPAC Name:
10-[3-(4-propan-2-ylpiperazin-1-yl)propyl]phenothiazine
InChI:
InChI=1S/C22H29N3S/c1-18(2)24-16-14-23(15-17-24)12-7-13-25-19-8-3-5-10-21(19)26-22-11-6-4-9-20(22)25/h3-6,8-11,18H,7,12-17H2,1-2H3
InChI Key:
CWWKIAKUQABPFP-UHFFFAOYSA-N
SMILES:
CC(N1CCN(CC1)CCCN1c2ccccc2Sc2c1cccc2)C
Properties
Complexity:
413
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
367.208g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
367.555g/mol
Monoisotopic Mass:
367.208g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
35A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
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