6-chloro-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-4-(oxan-4-yloxy)quinazoline

C24H23ClN4O3 — CID 165414881

IUPAC6-chloro-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-4-(oxan-4-yloxy)quinazoline
SMILESCn1cc(-c2ccccc2)nc1COc1nc(OC2CCOCC2)c2cc(Cl)ccc2n1
InChIInChI=1S/C24H23ClN4O3/c1-29-14-21(16-5-3-2-4-6-16)26-22(29)15-31-24-27-20-8-7-17(25)13-19(20)23(28-24)32-18-9-11-30-12-10-18/h2-8,13-14,18H,9-12,15H2,1H3
InChIKeyWVCDTSNCVGSEQT-UHFFFAOYSA-N
MW450.93 g/mol
LogP4.82
Rot. Bonds6

About 6-chloro-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-4-(oxan-4-yloxy)quinazoline

6-chloro-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-4-(oxan-4-yloxy)quinazoline (PubChem CID 165414881) has the molecular formula C24H23ClN4O3 and a molecular weight of 450.93 g/mol. Its IUPAC name is 6-chloro-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-4-(oxan-4-yloxy)quinazoline.

Molecular Properties

Compound Name6-chloro-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-4-(oxan-4-yloxy)quinazoline
PubChem CID165414881
Molecular FormulaC24H23ClN4O3
Molecular Weight450.93 g/mol
Exact Mass450.15
IUPAC Name6-chloro-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-4-(oxan-4-yloxy)quinazoline
SMILESCn1cc(-c2ccccc2)nc1COc1nc(OC2CCOCC2)c2cc(Cl)ccc2n1
InChIInChI=1S/C24H23ClN4O3/c1-29-14-21(16-5-3-2-4-6-16)26-22(29)15-31-24-27-20-8-7-17(25)13-19(20)23(28-24)32-18-9-11-30-12-10-18/h2-8,13-14,18H,9-12,15H2,1H3
InChIKeyWVCDTSNCVGSEQT-UHFFFAOYSA-N
XLogP4.82
TPSA71.29 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500450.93
LogP ≤ 54.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 6-chloro-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-4-(oxan-4-yloxy)quinazoline 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

8-(3,5-Dichloro-pyridin-4-ylmethoxy)-4-imidazol-1-yl-2-methyl-quinoline
CID 44191138
8-(3,5-Dichloro-pyridin-4-ylmethoxy)-2-methyl-4-(2-methyl-imidazol-1-yl)-quinoline
CID 44191220
8-(3,5-dichloro-pyridin-4-ylmethoxy)-2-methyl-4-(1-methyl-1H-imidazol-2-yl)-quinoline
CID 44191223
8-(3,5-dichloro-pyridin-4-ylmethoxy)-4-(1,5-dimethyl-1H-imidazol-2-yl)-2-methylquinoline
CID 44191224
8-[4-chloro-2-(trifluoromethyl)phenyl]-4-[6-methoxy-5-(4-methylimidazol-1-yl)pyridin-2-yl]-6,7,9,9a-tetrahydro-1H-pyrazino[1,2-d][1,2,4]oxadiazine
CID 126599817
Bamaluzole
CID 3086242
1-(4-(2-Chlorophenyl)piperazin-1-yl)-3-(quinazolin-4-yloxy)propan-2-ol (3b)
CID 118796622
1-(4-(3-Chlorophenyl)piperazin-1-yl)-3-(quinazolin-4-yloxy)propan-2-ol (3c)
CID 118796623
1-(4-(3,4-Dichlorophenyl)piperazin-1-yl)-3-(quinazolin-4-yloxy)propan-2-ol (3l)
CID 118796632
1-(1H-Imidazol-1-yl)-3-(quinazolin-4-yloxy)propan-2-ol (3t)
CID 118796637
1-(2-Methyl-1H-imidazol-1-yl)-3-(quinazolin-4-yloxy)propan-2-ol (3u)
CID 118796638
1-(4-Methyl-1H-imidazol-1-yl)-3-(quinazolin-4-yloxy)propan-2-ol (3v)
CID 118796639

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-4-(oxan-4-yloxy)quinazoline?
The IUPAC name of 6-chloro-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-4-(oxan-4-yloxy)quinazoline (CID 165414881) is 6-chloro-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-4-(oxan-4-yloxy)quinazoline.
What is the SMILES notation for 6-chloro-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-4-(oxan-4-yloxy)quinazoline?
The canonical SMILES for 6-chloro-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-4-(oxan-4-yloxy)quinazoline is Cn1cc(-c2ccccc2)nc1COc1nc(OC2CCOCC2)c2cc(Cl)ccc2n1.
What is the InChIKey of 6-chloro-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-4-(oxan-4-yloxy)quinazoline?
The InChIKey is WVCDTSNCVGSEQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23ClN4O3/c1-29-14-21(16-5-3-2-4-6-16)26-22(29)15-31-24-27-20-8-7-17(25)13-19(20)23(28-24)32-18-9-11-30-12-10-18/h2-8,13-14,18H,9-12,15H2,1H3.
What are the key properties of 6-chloro-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-4-(oxan-4-yloxy)quinazoline?
6-chloro-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-4-(oxan-4-yloxy)quinazoline has a molecular weight of 450.93 g/mol, XLogP of 4.82, 6 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]-4-(oxan-4-yloxy)quinazoline is sourced from PubChem (CID 165414881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).