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

C20H17ClN4O2 — CID 165414920

IUPAC6-chloro-4-methoxy-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinazoline
SMILESCOc1nc(OCc2nc(-c3ccccc3)cn2C)nc2ccc(Cl)cc12
InChIInChI=1S/C20H17ClN4O2/c1-25-11-17(13-6-4-3-5-7-13)22-18(25)12-27-20-23-16-9-8-14(21)10-15(16)19(24-20)26-2/h3-11H,12H2,1-2H3
InChIKeyFRTHNNBXEKZGNH-UHFFFAOYSA-N
MW380.84 g/mol
LogP4.27
Rot. Bonds5

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

6-chloro-4-methoxy-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinazoline (PubChem CID 165414920) has the molecular formula C20H17ClN4O2 and a molecular weight of 380.84 g/mol. Its IUPAC name is 6-chloro-4-methoxy-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinazoline.

Molecular Properties

Compound Name6-chloro-4-methoxy-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinazoline
PubChem CID165414920
Molecular FormulaC20H17ClN4O2
Molecular Weight380.84 g/mol
Exact Mass380.10
IUPAC Name6-chloro-4-methoxy-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinazoline
SMILESCOc1nc(OCc2nc(-c3ccccc3)cn2C)nc2ccc(Cl)cc12
InChIInChI=1S/C20H17ClN4O2/c1-25-11-17(13-6-4-3-5-7-13)22-18(25)12-27-20-23-16-9-8-14(21)10-15(16)19(24-20)26-2/h3-11H,12H2,1-2H3
InChIKeyFRTHNNBXEKZGNH-UHFFFAOYSA-N
XLogP4.27
TPSA62.06 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.84
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-4-methoxy-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinazoline?
The IUPAC name of 6-chloro-4-methoxy-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinazoline (CID 165414920) is 6-chloro-4-methoxy-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinazoline.
What is the SMILES notation for 6-chloro-4-methoxy-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinazoline?
The canonical SMILES for 6-chloro-4-methoxy-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinazoline is COc1nc(OCc2nc(-c3ccccc3)cn2C)nc2ccc(Cl)cc12.
What is the InChIKey of 6-chloro-4-methoxy-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinazoline?
The InChIKey is FRTHNNBXEKZGNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17ClN4O2/c1-25-11-17(13-6-4-3-5-7-13)22-18(25)12-27-20-23-16-9-8-14(21)10-15(16)19(24-20)26-2/h3-11H,12H2,1-2H3.
What are the key properties of 6-chloro-4-methoxy-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinazoline?
6-chloro-4-methoxy-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinazoline has a molecular weight of 380.84 g/mol, XLogP of 4.27, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-4-methoxy-2-[(1-methyl-4-phenylimidazol-2-yl)methoxy]quinazoline is sourced from PubChem (CID 165414920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).