GZHPOGVPEBAKBW-SNVBAGLBSA-N

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

C₂₀H₂₁F₄N₇OS — CID 71539661

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

IUPAC5-amino-N-[5-[(5R)-5-amino-3,3-difluoroazepan-1-yl]-1-methylpyrazol-4-yl]-2-(2,6-difluorophenyl)-1,3-thiazole-4-carboxamide

SMILESCn1ncc(NC(=O)c2nc(-c3c(F)cccc3F)sc2N)c1N1CC[C@@H](N)CC(F)(F)C1

InChIInChI=1S/C20H21F4N7OS/c1-30-19(31-6-5-10(25)7-20(23,24)9-31)13(8-27-30)28-17(32)15-16(26)33-18(29-15)14-11(21)3-2-4-12(14)22/h2-4,8,10H,5-7,9,25-26H2,1H3,(H,28,32)/t10-/m1/s1

InChIKeyGZHPOGVPEBAKBW-SNVBAGLBSA-N

MW483.50 g/mol

LogP3.22

Rot. Bonds4

About GZHPOGVPEBAKBW-SNVBAGLBSA-N

GZHPOGVPEBAKBW-SNVBAGLBSA-N (PubChem CID 71539661) has the molecular formula C₂₀H₂₁F₄N₇OS and a molecular weight of 483.50 g/mol. Its IUPAC name is 5-amino-N-[5-[(5R)-5-amino-3,3-difluoroazepan-1-yl]-1-methylpyrazol-4-yl]-2-(2,6-difluorophenyl)-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name	GZHPOGVPEBAKBW-SNVBAGLBSA-N
PubChem CID	71539661
Molecular Formula	C₂₀H₂₁F₄N₇OS
Molecular Weight	483.50 g/mol
Exact Mass	483.15
IUPAC Name	5-amino-N-[5-[(5R)-5-amino-3,3-difluoroazepan-1-yl]-1-methylpyrazol-4-yl]-2-(2,6-difluorophenyl)-1,3-thiazole-4-carboxamide
SMILES	Cn1ncc(NC(=O)c2nc(-c3c(F)cccc3F)sc2N)c1N1CC[C@@H](N)CC(F)(F)C1
InChI	InChI=1S/C20H21F4N7OS/c1-30-19(31-6-5-10(25)7-20(23,24)9-31)13(8-27-30)28-17(32)15-16(26)33-18(29-15)14-11(21)3-2-4-12(14)22/h2-4,8,10H,5-7,9,25-26H2,1H3,(H,28,32)/t10-/m1/s1
InChIKey	GZHPOGVPEBAKBW-SNVBAGLBSA-N
XLogP	3.22
TPSA	115.09 Å²
H-Bond Donors	3
H-Bond Acceptors	8
Rotatable Bonds	4
Heavy Atoms	33
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	483.50
LogP ≤ 5	3.22
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of GZHPOGVPEBAKBW-SNVBAGLBSA-N?

The IUPAC name of GZHPOGVPEBAKBW-SNVBAGLBSA-N (CID 71539661) is 5-amino-N-[5-[(5R)-5-amino-3,3-difluoroazepan-1-yl]-1-methylpyrazol-4-yl]-2-(2,6-difluorophenyl)-1,3-thiazole-4-carboxamide.

What is the SMILES notation for GZHPOGVPEBAKBW-SNVBAGLBSA-N?

The canonical SMILES for GZHPOGVPEBAKBW-SNVBAGLBSA-N is Cn1ncc(NC(=O)c2nc(-c3c(F)cccc3F)sc2N)c1N1CC[C@@H](N)CC(F)(F)C1.

What is the InChIKey of GZHPOGVPEBAKBW-SNVBAGLBSA-N?

The InChIKey is GZHPOGVPEBAKBW-SNVBAGLBSA-N. The full InChI is InChI=1S/C20H21F4N7OS/c1-30-19(31-6-5-10(25)7-20(23,24)9-31)13(8-27-30)28-17(32)15-16(26)33-18(29-15)14-11(21)3-2-4-12(14)22/h2-4,8,10H,5-7,9,25-26H2,1H3,(H,28,32)/t10-/m1/s1.

What are the key properties of GZHPOGVPEBAKBW-SNVBAGLBSA-N?

GZHPOGVPEBAKBW-SNVBAGLBSA-N has a molecular weight of 483.50 g/mol, XLogP of 3.22, 4 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for GZHPOGVPEBAKBW-SNVBAGLBSA-N is sourced from PubChem (CID 71539661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 71539661 — identifiers, structure, computed properties (public domain)

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