10-naphthalen-2-ylphenothiazine

C22H15NS — CID 141391080

IUPAC10-naphthalen-2-ylphenothiazine
SMILESc1ccc2c(c1)Sc1ccccc1N2c1ccc2ccccc2c1
InChIInChI=1S/C22H15NS/c1-2-8-17-15-18(14-13-16(17)7-1)23-19-9-3-5-11-21(19)24-22-12-6-4-10-20(22)23/h1-15H
InChIKeyHSLWNBYQKZYLTJ-UHFFFAOYSA-N
MW325.44 g/mol
LogP6.77
Rot. Bonds1

About 10-naphthalen-2-ylphenothiazine

10-naphthalen-2-ylphenothiazine (PubChem CID 141391080) has the molecular formula C22H15NS and a molecular weight of 325.44 g/mol. Its IUPAC name is 10-naphthalen-2-ylphenothiazine.

Molecular Properties

Compound Name10-naphthalen-2-ylphenothiazine
PubChem CID141391080
Molecular FormulaC22H15NS
Molecular Weight325.44 g/mol
Exact Mass325.09
IUPAC Name10-naphthalen-2-ylphenothiazine
SMILESc1ccc2c(c1)Sc1ccccc1N2c1ccc2ccccc2c1
InChIInChI=1S/C22H15NS/c1-2-8-17-15-18(14-13-16(17)7-1)23-19-9-3-5-11-21(19)24-22-12-6-4-10-20(22)23/h1-15H
InChIKeyHSLWNBYQKZYLTJ-UHFFFAOYSA-N
XLogP6.77
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500325.44
LogP ≤ 56.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-(4-cyclohexylphenyl)ethenyl]-10H-phenothiazine
CID 141758650
2-(1-phenylethenyl)-10H-phenothiazine
CID 149546367
10-Benzyl-10H-phenothiazine
CID 94075
7H-Benzo(c)phenothiazine
CID 219986
12H-Benzo(b)phenothiazine
CID 255516
(12H)-benzo(a)phenothiazine
CID 67469
2-(12H-benzo[a]phenothiazin-12-yl)-N,N-diethylethanamine
CID 227337
3-(12H-benzo[a]phenothiazin-12-yl)-N,N-dimethyl-1-propanamine
CID 227345
[3-(8,11-Dimethyl-benzo[c]phenothiazin-7-yl)-propyl]-dimethyl-amine
CID 229972
10-Methyl-7h-benzo[c]phenothiazine
CID 237061
3-(2-Chlorophenothiazin-10-yl)propyl-dimethyl-naphthalen-2-ylazanium
CID 10366260
N-methyl-3-phenothiazin-10-yl-N-(2-phenylethyl)propan-1-amine
CID 118724308

Frequently Asked Questions

What is the IUPAC name of 10-naphthalen-2-ylphenothiazine?
The IUPAC name of 10-naphthalen-2-ylphenothiazine (CID 141391080) is 10-naphthalen-2-ylphenothiazine.
What is the SMILES notation for 10-naphthalen-2-ylphenothiazine?
The canonical SMILES for 10-naphthalen-2-ylphenothiazine is c1ccc2c(c1)Sc1ccccc1N2c1ccc2ccccc2c1.
What is the InChIKey of 10-naphthalen-2-ylphenothiazine?
The InChIKey is HSLWNBYQKZYLTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15NS/c1-2-8-17-15-18(14-13-16(17)7-1)23-19-9-3-5-11-21(19)24-22-12-6-4-10-20(22)23/h1-15H.
What are the key properties of 10-naphthalen-2-ylphenothiazine?
10-naphthalen-2-ylphenothiazine has a molecular weight of 325.44 g/mol, XLogP of 6.77, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-naphthalen-2-ylphenothiazine is sourced from PubChem (CID 141391080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).