6-chloro-N-[6-[(7-chloroimidazo[1,2-a]pyridin-2-yl)methylcarbamoyl]oxan-3-yl]-4-hydroxy-3,4-dihydro-2H-chromene-2-carboxamide

C24H24Cl2N4O5 — CID 155254544

IUPAC6-chloro-N-[6-[(7-chloroimidazo[1,2-a]pyridin-2-yl)methylcarbamoyl]oxan-3-yl]-4-hydroxy-3,4-dihydro-2H-chromene-2-carboxamide
SMILESO=C(NCc1cn2ccc(Cl)cc2n1)C1CCC(NC(=O)C2CC(O)c3cc(Cl)ccc3O2)CO1
InChIInChI=1S/C24H24Cl2N4O5/c25-13-1-3-19-17(7-13)18(31)9-21(35-19)24(33)29-15-2-4-20(34-12-15)23(32)27-10-16-11-30-6-5-14(26)8-22(30)28-16/h1,3,5-8,11,15,18,20-21,31H,2,4,9-10,12H2,(H,27,32)(H,29,33)
InChIKeyJGLMMPAPPLROEV-UHFFFAOYSA-N
MW519.39 g/mol
LogP2.81
Rot. Bonds5

About 6-chloro-N-[6-[(7-chloroimidazo[1,2-a]pyridin-2-yl)methylcarbamoyl]oxan-3-yl]-4-hydroxy-3,4-dihydro-2H-chromene-2-carboxamide

6-chloro-N-[6-[(7-chloroimidazo[1,2-a]pyridin-2-yl)methylcarbamoyl]oxan-3-yl]-4-hydroxy-3,4-dihydro-2H-chromene-2-carboxamide (PubChem CID 155254544) has the molecular formula C24H24Cl2N4O5 and a molecular weight of 519.39 g/mol. Its IUPAC name is 6-chloro-N-[6-[(7-chloroimidazo[1,2-a]pyridin-2-yl)methylcarbamoyl]oxan-3-yl]-4-hydroxy-3,4-dihydro-2H-chromene-2-carboxamide.

Molecular Properties

Compound Name6-chloro-N-[6-[(7-chloroimidazo[1,2-a]pyridin-2-yl)methylcarbamoyl]oxan-3-yl]-4-hydroxy-3,4-dihydro-2H-chromene-2-carboxamide
PubChem CID155254544
Molecular FormulaC24H24Cl2N4O5
Molecular Weight519.39 g/mol
Exact Mass518.11
IUPAC Name6-chloro-N-[6-[(7-chloroimidazo[1,2-a]pyridin-2-yl)methylcarbamoyl]oxan-3-yl]-4-hydroxy-3,4-dihydro-2H-chromene-2-carboxamide
SMILESO=C(NCc1cn2ccc(Cl)cc2n1)C1CCC(NC(=O)C2CC(O)c3cc(Cl)ccc3O2)CO1
InChIInChI=1S/C24H24Cl2N4O5/c25-13-1-3-19-17(7-13)18(31)9-21(35-19)24(33)29-15-2-4-20(34-12-15)23(32)27-10-16-11-30-6-5-14(26)8-22(30)28-16/h1,3,5-8,11,15,18,20-21,31H,2,4,9-10,12H2,(H,27,32)(H,29,33)
InChIKeyJGLMMPAPPLROEV-UHFFFAOYSA-N
XLogP2.81
TPSA114.19 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500519.39
LogP ≤ 52.81
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Analyze 6-chloro-N-[6-[(7-chloroimidazo[1,2-a]pyridin-2-yl)methylcarbamoyl]oxan-3-yl]-4-hydroxy-3,4-dihydro-2H-chromene-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-[6-[(7-chloroimidazo[1,2-a]pyridin-2-yl)methylcarbamoyl]oxan-3-yl]-4-hydroxy-3,4-dihydro-2H-chromene-2-carboxamide?
The IUPAC name of 6-chloro-N-[6-[(7-chloroimidazo[1,2-a]pyridin-2-yl)methylcarbamoyl]oxan-3-yl]-4-hydroxy-3,4-dihydro-2H-chromene-2-carboxamide (CID 155254544) is 6-chloro-N-[6-[(7-chloroimidazo[1,2-a]pyridin-2-yl)methylcarbamoyl]oxan-3-yl]-4-hydroxy-3,4-dihydro-2H-chromene-2-carboxamide.
What is the SMILES notation for 6-chloro-N-[6-[(7-chloroimidazo[1,2-a]pyridin-2-yl)methylcarbamoyl]oxan-3-yl]-4-hydroxy-3,4-dihydro-2H-chromene-2-carboxamide?
The canonical SMILES for 6-chloro-N-[6-[(7-chloroimidazo[1,2-a]pyridin-2-yl)methylcarbamoyl]oxan-3-yl]-4-hydroxy-3,4-dihydro-2H-chromene-2-carboxamide is O=C(NCc1cn2ccc(Cl)cc2n1)C1CCC(NC(=O)C2CC(O)c3cc(Cl)ccc3O2)CO1.
What is the InChIKey of 6-chloro-N-[6-[(7-chloroimidazo[1,2-a]pyridin-2-yl)methylcarbamoyl]oxan-3-yl]-4-hydroxy-3,4-dihydro-2H-chromene-2-carboxamide?
The InChIKey is JGLMMPAPPLROEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24Cl2N4O5/c25-13-1-3-19-17(7-13)18(31)9-21(35-19)24(33)29-15-2-4-20(34-12-15)23(32)27-10-16-11-30-6-5-14(26)8-22(30)28-16/h1,3,5-8,11,15,18,20-21,31H,2,4,9-10,12H2,(H,27,32)(H,29,33).
What are the key properties of 6-chloro-N-[6-[(7-chloroimidazo[1,2-a]pyridin-2-yl)methylcarbamoyl]oxan-3-yl]-4-hydroxy-3,4-dihydro-2H-chromene-2-carboxamide?
6-chloro-N-[6-[(7-chloroimidazo[1,2-a]pyridin-2-yl)methylcarbamoyl]oxan-3-yl]-4-hydroxy-3,4-dihydro-2H-chromene-2-carboxamide has a molecular weight of 519.39 g/mol, XLogP of 2.81, 5 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-[6-[(7-chloroimidazo[1,2-a]pyridin-2-yl)methylcarbamoyl]oxan-3-yl]-4-hydroxy-3,4-dihydro-2H-chromene-2-carboxamide is sourced from PubChem (CID 155254544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).