CID 10673795

C34H26S3 — CID 10673795

IUPAC—
SMILESCc1cccc(C)c1-c1ccc2c(c1)C1(SC13CCSc1ccc4ccccc4c13)c1ccccc1S2
InChIInChI=1S/C34H26S3/c1-21-8-7-9-22(2)31(21)24-15-16-29-27(20-24)34(26-12-5-6-13-28(26)36-29)33(37-34)18-19-35-30-17-14-23-10-3-4-11-25(23)32(30)33/h3-17,20H,18-19H2,1-2H3
InChIKeySPYUVFYIIJNXEA-UHFFFAOYSA-N
MW530.78 g/mol
LogP9.97
Rot. Bonds1

About CID 10673795

CID 10673795 (PubChem CID 10673795) has the molecular formula C34H26S3 and a molecular weight of 530.78 g/mol.

Molecular Properties

Compound NameCID 10673795
PubChem CID10673795
Molecular FormulaC34H26S3
Molecular Weight530.78 g/mol
Exact Mass530.12
IUPAC Name—
SMILESCc1cccc(C)c1-c1ccc2c(c1)C1(SC13CCSc1ccc4ccccc4c13)c1ccccc1S2
InChIInChI=1S/C34H26S3/c1-21-8-7-9-22(2)31(21)24-15-16-29-27(20-24)34(26-12-5-6-13-28(26)36-29)33(37-34)18-19-35-30-17-14-23-10-3-4-11-25(23)32(30)33/h3-17,20H,18-19H2,1-2H3
InChIKeySPYUVFYIIJNXEA-UHFFFAOYSA-N
XLogP9.97
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms37
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500530.78
LogP ≤ 59.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

Analyze CID 10673795 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

11-methylspiro[benzo[c]fluorene-7,9'-thioxanthene]
CID 155036548
CID 86245135
CID 86245135
CID 11315798
CID 11315798
10-(2-methylphenyl)-2'-naphthalen-1-ylspiro[3,4-dihydroacridine-9,9'-thioxanthene]
CID 146519504
12-spiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene]-2-yl-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaene
CID 170036855
12-(4-spiro[benzo[a]fluorene-11,9'-fluorene]-2'-ylphenyl)-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9(17),10,12,14-octaene
CID 177126941
2-(2-methyl-10-naphthalen-2-ylanthracen-9-yl)-9H-thioxanthene
CID 89139320
2-anthracen-9-ylthianthrene
CID 132527057
2-naphthalen-1-yl-4-phenyl-6-spiro[fluorene-9,9'-thioxanthene]-2'-yl-1,3,5-triazine
CID 166738068
4-spiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.03,8.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaene]-4-yl-8-thiatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2(7),3,5,9,11,13(17),14-octaene
CID 170036712
2-[10-(9,9-dimethylfluoren-2-yl)-3-naphthalen-1-ylanthracen-9-yl]-10-methylphenothiazine
CID 59196364
6-(10-naphthalen-1-ylanthracen-9-yl)spiro[fluorene-9,9'-thioxanthene]-4-amine
CID 146215712

Frequently Asked Questions

What is the IUPAC name of CID 10673795?
The IUPAC name of CID 10673795 (CID 10673795) is not available.
What is the SMILES notation for CID 10673795?
The canonical SMILES for CID 10673795 is Cc1cccc(C)c1-c1ccc2c(c1)C1(SC13CCSc1ccc4ccccc4c13)c1ccccc1S2.
What is the InChIKey of CID 10673795?
The InChIKey is SPYUVFYIIJNXEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H26S3/c1-21-8-7-9-22(2)31(21)24-15-16-29-27(20-24)34(26-12-5-6-13-28(26)36-29)33(37-34)18-19-35-30-17-14-23-10-3-4-11-25(23)32(30)33/h3-17,20H,18-19H2,1-2H3.
What are the key properties of CID 10673795?
CID 10673795 has a molecular weight of 530.78 g/mol, XLogP of 9.97, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 10673795 is sourced from PubChem (CID 10673795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).