SRESTJLSXSERIZ-UHFFFAOYSA-N

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

C₂₉H₃₁F₂N₇O₃ — CID 151893338

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

IUPAC2-[4-[4-[[3-[4-(difluoromethoxy)phenyl]imidazo[1,2-a]pyrazin-8-yl]amino]-2-methylbenzoyl]piperazin-1-yl]-N,N-dimethylacetamide

SMILESCc1cc(Nc2nccn3c(-c4ccc(OC(F)F)cc4)cnc23)ccc1C(=O)N1CCN(CC(=O)N(C)C)CC1

InChIInChI=1S/C29H31F2N7O3/c1-19-16-21(6-9-23(19)28(40)37-14-12-36(13-15-37)18-25(39)35(2)3)34-26-27-33-17-24(38(27)11-10-32-26)20-4-7-22(8-5-20)41-29(30)31/h4-11,16-17,29H,12-15,18H2,1-3H3,(H,32,34)

InChIKeySRESTJLSXSERIZ-UHFFFAOYSA-N

MW563.61 g/mol

LogP3.90

Rot. Bonds8

About SRESTJLSXSERIZ-UHFFFAOYSA-N

SRESTJLSXSERIZ-UHFFFAOYSA-N (PubChem CID 151893338) has the molecular formula C₂₉H₃₁F₂N₇O₃ and a molecular weight of 563.61 g/mol. Its IUPAC name is 2-[4-[4-[[3-[4-(difluoromethoxy)phenyl]imidazo[1,2-a]pyrazin-8-yl]amino]-2-methylbenzoyl]piperazin-1-yl]-N,N-dimethylacetamide.

Molecular Properties

Compound Name	SRESTJLSXSERIZ-UHFFFAOYSA-N
PubChem CID	151893338
Molecular Formula	C₂₉H₃₁F₂N₇O₃
Molecular Weight	563.61 g/mol
Exact Mass	563.25
IUPAC Name	2-[4-[4-[[3-[4-(difluoromethoxy)phenyl]imidazo[1,2-a]pyrazin-8-yl]amino]-2-methylbenzoyl]piperazin-1-yl]-N,N-dimethylacetamide
SMILES	Cc1cc(Nc2nccn3c(-c4ccc(OC(F)F)cc4)cnc23)ccc1C(=O)N1CCN(CC(=O)N(C)C)CC1
InChI	InChI=1S/C29H31F2N7O3/c1-19-16-21(6-9-23(19)28(40)37-14-12-36(13-15-37)18-25(39)35(2)3)34-26-27-33-17-24(38(27)11-10-32-26)20-4-7-22(8-5-20)41-29(30)31/h4-11,16-17,29H,12-15,18H2,1-3H3,(H,32,34)
InChIKey	SRESTJLSXSERIZ-UHFFFAOYSA-N
XLogP	3.90
TPSA	95.31 Å²
H-Bond Donors	1
H-Bond Acceptors	8
Rotatable Bonds	8
Heavy Atoms	41
Complexity	—

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	563.61
LogP ≤ 5	3.90
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of SRESTJLSXSERIZ-UHFFFAOYSA-N?

The IUPAC name of SRESTJLSXSERIZ-UHFFFAOYSA-N (CID 151893338) is 2-[4-[4-[[3-[4-(difluoromethoxy)phenyl]imidazo[1,2-a]pyrazin-8-yl]amino]-2-methylbenzoyl]piperazin-1-yl]-N,N-dimethylacetamide.

What is the SMILES notation for SRESTJLSXSERIZ-UHFFFAOYSA-N?

The canonical SMILES for SRESTJLSXSERIZ-UHFFFAOYSA-N is Cc1cc(Nc2nccn3c(-c4ccc(OC(F)F)cc4)cnc23)ccc1C(=O)N1CCN(CC(=O)N(C)C)CC1.

What is the InChIKey of SRESTJLSXSERIZ-UHFFFAOYSA-N?

The InChIKey is SRESTJLSXSERIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H31F2N7O3/c1-19-16-21(6-9-23(19)28(40)37-14-12-36(13-15-37)18-25(39)35(2)3)34-26-27-33-17-24(38(27)11-10-32-26)20-4-7-22(8-5-20)41-29(30)31/h4-11,16-17,29H,12-15,18H2,1-3H3,(H,32,34).

What are the key properties of SRESTJLSXSERIZ-UHFFFAOYSA-N?

SRESTJLSXSERIZ-UHFFFAOYSA-N has a molecular weight of 563.61 g/mol, XLogP of 3.90, 8 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for SRESTJLSXSERIZ-UHFFFAOYSA-N is sourced from PubChem (CID 151893338), 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 151893338 — identifiers, structure, computed properties (public domain)

How this page is built: methodology · editorial policy & corrections.

For research and educational use only — not medical advice. This page is compiled automatically from public databases. It is not written or reviewed by a clinician. Do not start, stop or change any treatment based on it; consult a qualified healthcare professional. Spotted an error? See our corrections policy or email hello@molforge.ai.