(Z)-5-[(R)-(4-methylphenyl)sulfinyl]-4-phenylpent-4-en-1-ol

C18H20O2S — CID 11301041

IUPAC(Z)-5-[(R)-(4-methylphenyl)sulfinyl]-4-phenylpent-4-en-1-ol
SMILESCc1ccc([S@](=O)/C=C(/CCCO)c2ccccc2)cc1
InChIInChI=1S/C18H20O2S/c1-15-9-11-18(12-10-15)21(20)14-17(8-5-13-19)16-6-3-2-4-7-16/h2-4,6-7,9-12,14,19H,5,8,13H2,1H3/b17-14-/t21-/m1/s1
InChIKeyAHJCEGCMUOVHCB-RUDRXDDOSA-N
MW300.42 g/mol
LogP3.92
Rot. Bonds6

About (Z)-5-[(R)-(4-methylphenyl)sulfinyl]-4-phenylpent-4-en-1-ol

(Z)-5-[(R)-(4-methylphenyl)sulfinyl]-4-phenylpent-4-en-1-ol (PubChem CID 11301041) has the molecular formula C18H20O2S and a molecular weight of 300.42 g/mol. Its IUPAC name is (Z)-5-[(R)-(4-methylphenyl)sulfinyl]-4-phenylpent-4-en-1-ol.

Molecular Properties

Compound Name(Z)-5-[(R)-(4-methylphenyl)sulfinyl]-4-phenylpent-4-en-1-ol
PubChem CID11301041
Molecular FormulaC18H20O2S
Molecular Weight300.42 g/mol
Exact Mass300.12
IUPAC Name(Z)-5-[(R)-(4-methylphenyl)sulfinyl]-4-phenylpent-4-en-1-ol
SMILESCc1ccc([S@](=O)/C=C(/CCCO)c2ccccc2)cc1
InChIInChI=1S/C18H20O2S/c1-15-9-11-18(12-10-15)21(20)14-17(8-5-13-19)16-6-3-2-4-7-16/h2-4,6-7,9-12,14,19H,5,8,13H2,1H3/b17-14-/t21-/m1/s1
InChIKeyAHJCEGCMUOVHCB-RUDRXDDOSA-N
XLogP3.92
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.42
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (Z)-5-[(R)-(4-methylphenyl)sulfinyl]-4-phenylpent-4-en-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[(E)-1-(benzenesulfinyl)hex-1-en-2-yl]benzene
CID 138974661
(4-methylphenyl)sulfinylmethylidene-triphenyl-λ5-phosphane
CID 15372235
1-methyl-4-[(R)-[(Z)-2-[(E)-2-phenylethenyl]hex-1-enyl]sulfinyl]benzene
CID 11809512
[(Z)-2-(benzenesulfinyl)-1-chloroethenyl]benzene
CID 139262815
(2Z)-2-[(4-methylphenyl)sulfinylmethylidene]-1-phenylheptan-1-ol
CID 177426448
(Z)-3-(benzenesulfinyl)-2-iodoprop-2-en-1-ol
CID 101088179
(6Z)-6-[[(R)-(4-methylphenyl)sulfinyl]methylidene]decan-5-one
CID 53305514
3-[(E)-1-(4-methylphenyl)sulfinylhex-1-en-2-yl]cyclohex-2-en-1-one
CID 101371442
[4-(4-methylphenyl)sulfinylphenyl]-phenylmethanone
CID 11450048
1-methyl-4-(6-phenyldeca-3,5-dien-3-yl)benzene
CID 173389416
1-[(S)-[(Z)-1-chloro-2-phenylhex-1-enyl]sulfinyl]-4-methylbenzene
CID 134875983
1-[(Z)-6-iodo-2-(4-methylphenyl)sulfinylhex-1-enyl]sulfinyl-4-methylbenzene
CID 101150706

Frequently Asked Questions

What is the IUPAC name of (Z)-5-[(R)-(4-methylphenyl)sulfinyl]-4-phenylpent-4-en-1-ol?
The IUPAC name of (Z)-5-[(R)-(4-methylphenyl)sulfinyl]-4-phenylpent-4-en-1-ol (CID 11301041) is (Z)-5-[(R)-(4-methylphenyl)sulfinyl]-4-phenylpent-4-en-1-ol.
What is the SMILES notation for (Z)-5-[(R)-(4-methylphenyl)sulfinyl]-4-phenylpent-4-en-1-ol?
The canonical SMILES for (Z)-5-[(R)-(4-methylphenyl)sulfinyl]-4-phenylpent-4-en-1-ol is Cc1ccc([S@](=O)/C=C(/CCCO)c2ccccc2)cc1.
What is the InChIKey of (Z)-5-[(R)-(4-methylphenyl)sulfinyl]-4-phenylpent-4-en-1-ol?
The InChIKey is AHJCEGCMUOVHCB-RUDRXDDOSA-N. The full InChI is InChI=1S/C18H20O2S/c1-15-9-11-18(12-10-15)21(20)14-17(8-5-13-19)16-6-3-2-4-7-16/h2-4,6-7,9-12,14,19H,5,8,13H2,1H3/b17-14-/t21-/m1/s1.
What are the key properties of (Z)-5-[(R)-(4-methylphenyl)sulfinyl]-4-phenylpent-4-en-1-ol?
(Z)-5-[(R)-(4-methylphenyl)sulfinyl]-4-phenylpent-4-en-1-ol has a molecular weight of 300.42 g/mol, XLogP of 3.92, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-5-[(R)-(4-methylphenyl)sulfinyl]-4-phenylpent-4-en-1-ol is sourced from PubChem (CID 11301041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).