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65240-94-0 | N,N-BIS(2-HYDROXYETHYL)-2-CHLORO-10H-PHENOTHIAZINE-10-CARBOXAMIDE
CAS No: 65240-94-0 Catalog No: AG00H6NG MDL No:
Product Description
Catalog Number:
AG00H6NG
Chemical Name:
N,N-BIS(2-HYDROXYETHYL)-2-CHLORO-10H-PHENOTHIAZINE-10-CARBOXAMIDE
CAS Number:
65240-94-0
Molecular Formula:
C17H17ClN2O3S
Molecular Weight:
364.8465
IUPAC Name:
2-chloro-N,N-bis(2-hydroxyethyl)phenothiazine-10-carboxamide
InChI:
InChI=1S/C17H17ClN2O3S/c18-12-5-6-16-14(11-12)20(13-3-1-2-4-15(13)24-16)17(23)19(7-9-21)8-10-22/h1-6,11,21-22H,7-10H2
InChI Key:
WOFGZPMVQMGMBV-UHFFFAOYSA-N
SMILES:
OCCN(C(=O)N1c2ccccc2Sc2c1cc(Cl)cc2)CCO
Properties
Complexity:
436
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
364.065g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
364.844g/mol
Monoisotopic Mass:
364.065g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
89.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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