UOGYUWPVJWOUCP-LPHOPBHVSA-N

Name: UOGYUWPVJWOUCP-LPHOPBHVSA-N — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₂₄H₁₉F₃N₂O₄S — CID 118153319

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC(3S,5S)-3-[2-(difluoromethoxy)phenyl]-10-fluoro-11-(4-methylsulfonylphenyl)-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),7,9,11-tetraen-5-ol

SMILESCS(=O)(=O)c1ccc(-c2cn3c4c(nc3cc2F)[C@@H](O)C[C@H]4c2ccccc2OC(F)F)cc1

InChIInChI=1S/C24H19F3N2O4S/c1-34(31,32)14-8-6-13(7-9-14)17-12-29-21(11-18(17)25)28-22-19(30)10-16(23(22)29)15-4-2-3-5-20(15)33-24(26)27/h2-9,11-12,16,19,24,30H,10H2,1H3/t16-,19-/m0/s1

InChIKeyUOGYUWPVJWOUCP-LPHOPBHVSA-N

MW488.49 g/mol

LogP4.71

Rot. Bonds5

About UOGYUWPVJWOUCP-LPHOPBHVSA-N

UOGYUWPVJWOUCP-LPHOPBHVSA-N (PubChem CID 118153319) has the molecular formula C₂₄H₁₉F₃N₂O₄S and a molecular weight of 488.49 g/mol. Its IUPAC name is (3S,5S)-3-[2-(difluoromethoxy)phenyl]-10-fluoro-11-(4-methylsulfonylphenyl)-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),7,9,11-tetraen-5-ol.

Molecular Properties

Compound Name	UOGYUWPVJWOUCP-LPHOPBHVSA-N
PubChem CID	118153319
Molecular Formula	C₂₄H₁₉F₃N₂O₄S
Molecular Weight	488.49 g/mol
Exact Mass	488.10
IUPAC Name	(3S,5S)-3-[2-(difluoromethoxy)phenyl]-10-fluoro-11-(4-methylsulfonylphenyl)-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),7,9,11-tetraen-5-ol
SMILES	CS(=O)(=O)c1ccc(-c2cn3c4c(nc3cc2F)[C@@H](O)C[C@H]4c2ccccc2OC(F)F)cc1
InChI	InChI=1S/C24H19F3N2O4S/c1-34(31,32)14-8-6-13(7-9-14)17-12-29-21(11-18(17)25)28-22-19(30)10-16(23(22)29)15-4-2-3-5-20(15)33-24(26)27/h2-9,11-12,16,19,24,30H,10H2,1H3/t16-,19-/m0/s1
InChIKey	UOGYUWPVJWOUCP-LPHOPBHVSA-N
XLogP	4.71
TPSA	80.90 Å²
H-Bond Donors	1
H-Bond Acceptors	6
Rotatable Bonds	5
Heavy Atoms	34
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	488.49
LogP ≤ 5	4.71
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of UOGYUWPVJWOUCP-LPHOPBHVSA-N?

The IUPAC name of UOGYUWPVJWOUCP-LPHOPBHVSA-N (CID 118153319) is (3S,5S)-3-[2-(difluoromethoxy)phenyl]-10-fluoro-11-(4-methylsulfonylphenyl)-1,7-diazatricyclo[6.4.0.02,6]dodeca-2(6),7,9,11-tetraen-5-ol.

What is the SMILES notation for UOGYUWPVJWOUCP-LPHOPBHVSA-N?

The canonical SMILES for UOGYUWPVJWOUCP-LPHOPBHVSA-N is CS(=O)(=O)c1ccc(-c2cn3c4c(nc3cc2F)[C@@H](O)C[C@H]4c2ccccc2OC(F)F)cc1.

What is the InChIKey of UOGYUWPVJWOUCP-LPHOPBHVSA-N?

The InChIKey is UOGYUWPVJWOUCP-LPHOPBHVSA-N. The full InChI is InChI=1S/C24H19F3N2O4S/c1-34(31,32)14-8-6-13(7-9-14)17-12-29-21(11-18(17)25)28-22-19(30)10-16(23(22)29)15-4-2-3-5-20(15)33-24(26)27/h2-9,11-12,16,19,24,30H,10H2,1H3/t16-,19-/m0/s1.

What are the key properties of UOGYUWPVJWOUCP-LPHOPBHVSA-N?

UOGYUWPVJWOUCP-LPHOPBHVSA-N has a molecular weight of 488.49 g/mol, XLogP of 4.71, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for UOGYUWPVJWOUCP-LPHOPBHVSA-N is sourced from PubChem (CID 118153319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Browse: Molecules A–Z · all molecules A–Z · drugs A–Z · protein targets A–Z.

Sources

PubChem CID 118153319 — identifiers, structure, computed properties (public domain)

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