ZOHVYFFYFCNUAZ-QFIPXVFZSA-N

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

C₂₅H₂₃F₈NO₅S₂ — CID 118217911

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

IUPAC(1,1-dioxothian-4-yl)-[(3R)-3-(4-fluorophenyl)sulfonyl-3-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)phenyl]pyrrolidin-1-yl]methanone

SMILESO=C(C1CCS(=O)(=O)CC1)N1CC[C@](c2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)(S(=O)(=O)c2ccc(F)cc2)C1

InChIInChI=1S/C25H23F8NO5S2/c26-19-5-7-20(8-6-19)41(38,39)22(11-12-34(15-22)21(35)16-9-13-40(36,37)14-10-16)17-1-3-18(4-2-17)23(27,24(28,29)30)25(31,32)33/h1-8,16H,9-15H2/t22-/m0/s1

InChIKeyZOHVYFFYFCNUAZ-QFIPXVFZSA-N

MW633.58 g/mol

LogP4.84

Rot. Bonds5

About ZOHVYFFYFCNUAZ-QFIPXVFZSA-N

ZOHVYFFYFCNUAZ-QFIPXVFZSA-N (PubChem CID 118217911) has the molecular formula C₂₅H₂₃F₈NO₅S₂ and a molecular weight of 633.58 g/mol. Its IUPAC name is (1,1-dioxothian-4-yl)-[(3R)-3-(4-fluorophenyl)sulfonyl-3-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)phenyl]pyrrolidin-1-yl]methanone.

Molecular Properties

Compound Name	ZOHVYFFYFCNUAZ-QFIPXVFZSA-N
PubChem CID	118217911
Molecular Formula	C₂₅H₂₃F₈NO₅S₂
Molecular Weight	633.58 g/mol
Exact Mass	633.09
IUPAC Name	(1,1-dioxothian-4-yl)-[(3R)-3-(4-fluorophenyl)sulfonyl-3-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)phenyl]pyrrolidin-1-yl]methanone
SMILES	O=C(C1CCS(=O)(=O)CC1)N1CC[C@](c2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)(S(=O)(=O)c2ccc(F)cc2)C1
InChI	InChI=1S/C25H23F8NO5S2/c26-19-5-7-20(8-6-19)41(38,39)22(11-12-34(15-22)21(35)16-9-13-40(36,37)14-10-16)17-1-3-18(4-2-17)23(27,24(28,29)30)25(31,32)33/h1-8,16H,9-15H2/t22-/m0/s1
InChIKey	ZOHVYFFYFCNUAZ-QFIPXVFZSA-N
XLogP	4.84
TPSA	88.59 Å²
H-Bond Donors
H-Bond Acceptors	5
Rotatable Bonds	5
Heavy Atoms	41
Complexity	—

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	633.58
LogP ≤ 5	4.84
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of ZOHVYFFYFCNUAZ-QFIPXVFZSA-N?

The IUPAC name of ZOHVYFFYFCNUAZ-QFIPXVFZSA-N (CID 118217911) is (1,1-dioxothian-4-yl)-[(3R)-3-(4-fluorophenyl)sulfonyl-3-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)phenyl]pyrrolidin-1-yl]methanone.

What is the SMILES notation for ZOHVYFFYFCNUAZ-QFIPXVFZSA-N?

The canonical SMILES for ZOHVYFFYFCNUAZ-QFIPXVFZSA-N is O=C(C1CCS(=O)(=O)CC1)N1CC[C@](c2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)(S(=O)(=O)c2ccc(F)cc2)C1.

What is the InChIKey of ZOHVYFFYFCNUAZ-QFIPXVFZSA-N?

The InChIKey is ZOHVYFFYFCNUAZ-QFIPXVFZSA-N. The full InChI is InChI=1S/C25H23F8NO5S2/c26-19-5-7-20(8-6-19)41(38,39)22(11-12-34(15-22)21(35)16-9-13-40(36,37)14-10-16)17-1-3-18(4-2-17)23(27,24(28,29)30)25(31,32)33/h1-8,16H,9-15H2/t22-/m0/s1.

What are the key properties of ZOHVYFFYFCNUAZ-QFIPXVFZSA-N?

ZOHVYFFYFCNUAZ-QFIPXVFZSA-N has a molecular weight of 633.58 g/mol, XLogP of 4.84, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for ZOHVYFFYFCNUAZ-QFIPXVFZSA-N is sourced from PubChem (CID 118217911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 118217911 — identifiers, structure, computed properties (public domain)

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