5-[[2,7-dichloro-4-(furan-2-ylmethylamino)quinazolin-8-yl]oxymethyl]-3-methyl-1,3-oxazolidin-2-one

C18H16Cl2N4O4 — CID 171562018

IUPAC5-[[2,7-dichloro-4-(furan-2-ylmethylamino)quinazolin-8-yl]oxymethyl]-3-methyl-1,3-oxazolidin-2-one
SMILESCN1CC(COc2c(Cl)ccc3c(NCc4ccco4)nc(Cl)nc23)OC1=O
InChIInChI=1S/C18H16Cl2N4O4/c1-24-8-11(28-18(24)25)9-27-15-13(19)5-4-12-14(15)22-17(20)23-16(12)21-7-10-3-2-6-26-10/h2-6,11H,7-9H2,1H3,(H,21,22,23)
InChIKeyMJSBCGCQADZUSA-UHFFFAOYSA-N
MW423.26 g/mol
LogP3.97
Rot. Bonds6

About 5-[[2,7-dichloro-4-(furan-2-ylmethylamino)quinazolin-8-yl]oxymethyl]-3-methyl-1,3-oxazolidin-2-one

5-[[2,7-dichloro-4-(furan-2-ylmethylamino)quinazolin-8-yl]oxymethyl]-3-methyl-1,3-oxazolidin-2-one (PubChem CID 171562018) has the molecular formula C18H16Cl2N4O4 and a molecular weight of 423.26 g/mol. Its IUPAC name is 5-[[2,7-dichloro-4-(furan-2-ylmethylamino)quinazolin-8-yl]oxymethyl]-3-methyl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name5-[[2,7-dichloro-4-(furan-2-ylmethylamino)quinazolin-8-yl]oxymethyl]-3-methyl-1,3-oxazolidin-2-one
PubChem CID171562018
Molecular FormulaC18H16Cl2N4O4
Molecular Weight423.26 g/mol
Exact Mass422.05
IUPAC Name5-[[2,7-dichloro-4-(furan-2-ylmethylamino)quinazolin-8-yl]oxymethyl]-3-methyl-1,3-oxazolidin-2-one
SMILESCN1CC(COc2c(Cl)ccc3c(NCc4ccco4)nc(Cl)nc23)OC1=O
InChIInChI=1S/C18H16Cl2N4O4/c1-24-8-11(28-18(24)25)9-27-15-13(19)5-4-12-14(15)22-17(20)23-16(12)21-7-10-3-2-6-26-10/h2-6,11H,7-9H2,1H3,(H,21,22,23)
InChIKeyMJSBCGCQADZUSA-UHFFFAOYSA-N
XLogP3.97
TPSA89.72 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500423.26
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 5-[[2,7-dichloro-4-(furan-2-ylmethylamino)quinazolin-8-yl]oxymethyl]-3-methyl-1,3-oxazolidin-2-one with MolForge

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

Launch Full Analysis

Related Compounds

4-[[2-chloro-4-(furan-2-ylmethylamino)quinazolin-8-yl]oxymethyl]-1-(2-fluoroethyl)pyrrolidin-2-one
CID 171561938
2-chloro-4-(furan-2-ylmethylamino)quinazolin-8-ol
CID 171561832
5-[[2-chloro-4-(furan-2-ylmethylamino)quinazolin-8-yl]oxymethyl]-5-methylpyrrolidin-2-one
CID 171561853
2-chloro-N-(furan-2-ylmethyl)-6-methoxyquinazolin-4-amine
CID 171562066
2-chloro-5-[(cyclohexylamino)-fluoromethyl]-N-(furan-2-ylmethyl)-7-methylpyrrolo[3,2-d]pyrimidin-4-amine
CID 170644513
2-chloro-6-ethoxy-N-(furan-2-ylmethyl)-7-methoxyquinazolin-4-amine
CID 171562089
2-chloro-4-N-(furan-2-ylmethyl)-6-methylpyrimidine-4,5-diamine
CID 7147199
2-[2-chloro-4-(furan-2-ylmethylamino)pyrrolo[2,3-d]pyrimidin-7-yl]-N-methylacetamide
CID 134480903
2-chloro-N-(furan-2-ylmethyl)-8-[[(2S)-oxolan-2-yl]methoxy]-7H-purin-6-amine
CID 134480891
8-chloro-2-(1,4-dioxan-2-ylmethoxy)-N-(furan-2-ylmethyl)pyrido[3,2-d]pyrimidin-4-amine
CID 171561803
2-[2-chloro-4-(furan-2-ylmethylamino)-7-methoxyquinazolin-6-yl]oxyethanol
CID 171562096
2,7-dichloro-5-N-fluoro-4-N-(furan-2-ylmethyl)-5-N-(oxan-3-yl)pyrrolo[3,2-d]pyrimidine-4,5-diamine;ethane
CID 170644127

Frequently Asked Questions

What is the IUPAC name of 5-[[2,7-dichloro-4-(furan-2-ylmethylamino)quinazolin-8-yl]oxymethyl]-3-methyl-1,3-oxazolidin-2-one?
The IUPAC name of 5-[[2,7-dichloro-4-(furan-2-ylmethylamino)quinazolin-8-yl]oxymethyl]-3-methyl-1,3-oxazolidin-2-one (CID 171562018) is 5-[[2,7-dichloro-4-(furan-2-ylmethylamino)quinazolin-8-yl]oxymethyl]-3-methyl-1,3-oxazolidin-2-one.
What is the SMILES notation for 5-[[2,7-dichloro-4-(furan-2-ylmethylamino)quinazolin-8-yl]oxymethyl]-3-methyl-1,3-oxazolidin-2-one?
The canonical SMILES for 5-[[2,7-dichloro-4-(furan-2-ylmethylamino)quinazolin-8-yl]oxymethyl]-3-methyl-1,3-oxazolidin-2-one is CN1CC(COc2c(Cl)ccc3c(NCc4ccco4)nc(Cl)nc23)OC1=O.
What is the InChIKey of 5-[[2,7-dichloro-4-(furan-2-ylmethylamino)quinazolin-8-yl]oxymethyl]-3-methyl-1,3-oxazolidin-2-one?
The InChIKey is MJSBCGCQADZUSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16Cl2N4O4/c1-24-8-11(28-18(24)25)9-27-15-13(19)5-4-12-14(15)22-17(20)23-16(12)21-7-10-3-2-6-26-10/h2-6,11H,7-9H2,1H3,(H,21,22,23).
What are the key properties of 5-[[2,7-dichloro-4-(furan-2-ylmethylamino)quinazolin-8-yl]oxymethyl]-3-methyl-1,3-oxazolidin-2-one?
5-[[2,7-dichloro-4-(furan-2-ylmethylamino)quinazolin-8-yl]oxymethyl]-3-methyl-1,3-oxazolidin-2-one has a molecular weight of 423.26 g/mol, XLogP of 3.97, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[2,7-dichloro-4-(furan-2-ylmethylamino)quinazolin-8-yl]oxymethyl]-3-methyl-1,3-oxazolidin-2-one is sourced from PubChem (CID 171562018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).