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26197-31-9 | 5H-Benzo[a]phenothiazin-5-one, 6-methyl-
CAS No: 26197-31-9 Catalog No: AG002S81 MDL No:
Product Description
Catalog Number:
AG002S81
Chemical Name:
5H-Benzo[a]phenothiazin-5-one, 6-methyl-
CAS Number:
26197-31-9
Molecular Formula:
C17H11NOS
Molecular Weight:
277.3403
IUPAC Name:
6-methylbenzo[a]phenothiazin-5-one
InChI:
InChI=1S/C17H11NOS/c1-10-16(19)12-7-3-2-6-11(12)15-17(10)20-14-9-5-4-8-13(14)18-15/h2-9H,1H3
InChI Key:
RTPGWOYHPVTPOX-UHFFFAOYSA-N
SMILES:
O=c1c(C)c2sc3ccccc3nc2c2c1cccc2
UNII:
DP1KSR9RRX
NSC Number:
129958
Properties
Complexity:
507
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.056g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
277.341g/mol
Monoisotopic Mass:
277.056g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
Literature
| Title | Journal |
|---|---|
| Combination of benzo[a]phenothiazines with acyclovir against herpes simplex virus. | International journal of antimicrobial agents 20010701 |
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