1-[(1R)-1-[[(1R)-1-naphthalen-1-ylethyl]disulfanyl]ethyl]naphthalene

C24H22S2 — CID 131854345

IUPAC1-[(1R)-1-[[(1R)-1-naphthalen-1-ylethyl]disulfanyl]ethyl]naphthalene
SMILESC[C@@H](SS[C@H](C)c1cccc2ccccc12)c1cccc2ccccc12
InChIInChI=1S/C24H22S2/c1-17(21-15-7-11-19-9-3-5-13-23(19)21)25-26-18(2)22-16-8-12-20-10-4-6-14-24(20)22/h3-18H,1-2H3/t17-,18-/m1/s1
InChIKeyUHAPMTGUHDERLV-QZTJIDSGSA-N
MW374.57 g/mol
LogP8.20
Rot. Bonds5

About 1-[(1R)-1-[[(1R)-1-naphthalen-1-ylethyl]disulfanyl]ethyl]naphthalene

1-[(1R)-1-[[(1R)-1-naphthalen-1-ylethyl]disulfanyl]ethyl]naphthalene (PubChem CID 131854345) has the molecular formula C24H22S2 and a molecular weight of 374.57 g/mol. Its IUPAC name is 1-[(1R)-1-[[(1R)-1-naphthalen-1-ylethyl]disulfanyl]ethyl]naphthalene.

Molecular Properties

Compound Name1-[(1R)-1-[[(1R)-1-naphthalen-1-ylethyl]disulfanyl]ethyl]naphthalene
PubChem CID131854345
Molecular FormulaC24H22S2
Molecular Weight374.57 g/mol
Exact Mass374.12
IUPAC Name1-[(1R)-1-[[(1R)-1-naphthalen-1-ylethyl]disulfanyl]ethyl]naphthalene
SMILESC[C@@H](SS[C@H](C)c1cccc2ccccc12)c1cccc2ccccc12
InChIInChI=1S/C24H22S2/c1-17(21-15-7-11-19-9-3-5-13-23(19)21)25-26-18(2)22-16-8-12-20-10-4-6-14-24(20)22/h3-18H,1-2H3/t17-,18-/m1/s1
InChIKeyUHAPMTGUHDERLV-QZTJIDSGSA-N
XLogP8.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500374.57
LogP ≤ 58.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'disulphide', 'substructure': 'N/A'}

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Related Compounds

1-[1-(trifluoromethylsulfanyl)ethyl]naphthalene
CID 175278434
butane;1-propan-2-ylnaphthalene
CID 157253186
1-(2-methyl-1-naphthalen-1-ylpropyl)naphthalene
CID 174755343
ethane;methane;1-propan-2-ylnaphthalene
CID 160778548
CID 174906138
CID 174906138
potassium [(1S)-1-naphthalen-1-ylethyl]azanide
CID 100993742
2-methyl-1-naphthalen-1-ylpropan-1-amine
CID 14948205
3-naphthalen-1-ylpentane-2,4-diol
CID 140608407
deuterium monohydride;(1R)-1-naphthalen-1-ylethanamine
CID 158157747
1-(3-chlorobutan-2-yl)naphthalene
CID 66471856
1-[(2R)-butan-2-yl]naphthalene;pentane
CID 142150914
(1S,2S)-1,2-dinaphthalen-1-ylethane-1,2-diol
CID 10470897

Frequently Asked Questions

What is the IUPAC name of 1-[(1R)-1-[[(1R)-1-naphthalen-1-ylethyl]disulfanyl]ethyl]naphthalene?
The IUPAC name of 1-[(1R)-1-[[(1R)-1-naphthalen-1-ylethyl]disulfanyl]ethyl]naphthalene (CID 131854345) is 1-[(1R)-1-[[(1R)-1-naphthalen-1-ylethyl]disulfanyl]ethyl]naphthalene.
What is the SMILES notation for 1-[(1R)-1-[[(1R)-1-naphthalen-1-ylethyl]disulfanyl]ethyl]naphthalene?
The canonical SMILES for 1-[(1R)-1-[[(1R)-1-naphthalen-1-ylethyl]disulfanyl]ethyl]naphthalene is C[C@@H](SS[C@H](C)c1cccc2ccccc12)c1cccc2ccccc12.
What is the InChIKey of 1-[(1R)-1-[[(1R)-1-naphthalen-1-ylethyl]disulfanyl]ethyl]naphthalene?
The InChIKey is UHAPMTGUHDERLV-QZTJIDSGSA-N. The full InChI is InChI=1S/C24H22S2/c1-17(21-15-7-11-19-9-3-5-13-23(19)21)25-26-18(2)22-16-8-12-20-10-4-6-14-24(20)22/h3-18H,1-2H3/t17-,18-/m1/s1.
What are the key properties of 1-[(1R)-1-[[(1R)-1-naphthalen-1-ylethyl]disulfanyl]ethyl]naphthalene?
1-[(1R)-1-[[(1R)-1-naphthalen-1-ylethyl]disulfanyl]ethyl]naphthalene has a molecular weight of 374.57 g/mol, XLogP of 8.20, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1R)-1-[[(1R)-1-naphthalen-1-ylethyl]disulfanyl]ethyl]naphthalene is sourced from PubChem (CID 131854345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).