1-[3-(2-methoxyethyl)-4-oxoquinazolin-6-yl]-3-(3-methoxyphenyl)urea

C19H20N4O4 — CID 162429378

IUPAC1-[3-(2-methoxyethyl)-4-oxoquinazolin-6-yl]-3-(3-methoxyphenyl)urea
SMILESCOCCn1cnc2ccc(NC(=O)Nc3cccc(OC)c3)cc2c1=O
InChIInChI=1S/C19H20N4O4/c1-26-9-8-23-12-20-17-7-6-14(11-16(17)18(23)24)22-19(25)21-13-4-3-5-15(10-13)27-2/h3-7,10-12H,8-9H2,1-2H3,(H2,21,22,25)
InChIKeyZRVMIPSWTRXABL-UHFFFAOYSA-N
MW368.39 g/mol
LogP2.70
Rot. Bonds6

About 1-[3-(2-methoxyethyl)-4-oxoquinazolin-6-yl]-3-(3-methoxyphenyl)urea

1-[3-(2-methoxyethyl)-4-oxoquinazolin-6-yl]-3-(3-methoxyphenyl)urea (PubChem CID 162429378) has the molecular formula C19H20N4O4 and a molecular weight of 368.39 g/mol. Its IUPAC name is 1-[3-(2-methoxyethyl)-4-oxoquinazolin-6-yl]-3-(3-methoxyphenyl)urea.

Molecular Properties

Compound Name1-[3-(2-methoxyethyl)-4-oxoquinazolin-6-yl]-3-(3-methoxyphenyl)urea
PubChem CID162429378
Molecular FormulaC19H20N4O4
Molecular Weight368.39 g/mol
Exact Mass368.15
IUPAC Name1-[3-(2-methoxyethyl)-4-oxoquinazolin-6-yl]-3-(3-methoxyphenyl)urea
SMILESCOCCn1cnc2ccc(NC(=O)Nc3cccc(OC)c3)cc2c1=O
InChIInChI=1S/C19H20N4O4/c1-26-9-8-23-12-20-17-7-6-14(11-16(17)18(23)24)22-19(25)21-13-4-3-5-15(10-13)27-2/h3-7,10-12H,8-9H2,1-2H3,(H2,21,22,25)
InChIKeyZRVMIPSWTRXABL-UHFFFAOYSA-N
XLogP2.70
TPSA94.48 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.39
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

1-[3-(2-methoxyethyl)-4-oxoquinazolin-6-yl]-3-phenylurea
CID 162429400
1-[3-(2-methoxyethyl)-4-oxoquinazolin-6-yl]-3-[4-(trifluoromethoxy)phenyl]urea
CID 162429621
1-(3-chloro-4-fluorophenyl)-3-[3-(2-methoxyethyl)-4-oxoquinazolin-6-yl]urea
CID 162429270
6-(hydroxyamino)-3-(2-methoxyethyl)quinazolin-4-one
CID 162429544
2-(6-fluoro-4-oxoquinazolin-3-yl)-N-(3-methoxyphenyl)acetamide
CID 46584174
1-(4-acetylphenyl)-3-[3-(2-methoxyethyl)-4-oxoquinazolin-7-yl]urea
CID 162429447
N-[3-(2-methoxyethyl)-4-oxoquinazolin-6-yl]-2-(4-pyrrol-1-yloxan-4-yl)acetamide
CID 91639946
N-[3-(2-methoxyethyl)-4-oxoquinazolin-6-yl]-2-(4-methyl-2-oxochromen-7-yl)oxyacetamide
CID 71826913
3-(2-methoxyethyl)pyrido[4,3-d]pyrimidin-4-one
CID 39817833
2-hydroxy-N-[3-[(4-methoxyphenyl)methyl]-4-oxoquinazolin-6-yl]acetamide
CID 25158966
1-(3H-benzimidazol-5-yl)-3-(3-methoxyphenyl)urea
CID 108869161
1-(4-acetylphenyl)-3-(3-ethyl-4-oxoquinazolin-6-yl)urea
CID 162429338

Frequently Asked Questions

What is the IUPAC name of 1-[3-(2-methoxyethyl)-4-oxoquinazolin-6-yl]-3-(3-methoxyphenyl)urea?
The IUPAC name of 1-[3-(2-methoxyethyl)-4-oxoquinazolin-6-yl]-3-(3-methoxyphenyl)urea (CID 162429378) is 1-[3-(2-methoxyethyl)-4-oxoquinazolin-6-yl]-3-(3-methoxyphenyl)urea.
What is the SMILES notation for 1-[3-(2-methoxyethyl)-4-oxoquinazolin-6-yl]-3-(3-methoxyphenyl)urea?
The canonical SMILES for 1-[3-(2-methoxyethyl)-4-oxoquinazolin-6-yl]-3-(3-methoxyphenyl)urea is COCCn1cnc2ccc(NC(=O)Nc3cccc(OC)c3)cc2c1=O.
What is the InChIKey of 1-[3-(2-methoxyethyl)-4-oxoquinazolin-6-yl]-3-(3-methoxyphenyl)urea?
The InChIKey is ZRVMIPSWTRXABL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O4/c1-26-9-8-23-12-20-17-7-6-14(11-16(17)18(23)24)22-19(25)21-13-4-3-5-15(10-13)27-2/h3-7,10-12H,8-9H2,1-2H3,(H2,21,22,25).
What are the key properties of 1-[3-(2-methoxyethyl)-4-oxoquinazolin-6-yl]-3-(3-methoxyphenyl)urea?
1-[3-(2-methoxyethyl)-4-oxoquinazolin-6-yl]-3-(3-methoxyphenyl)urea has a molecular weight of 368.39 g/mol, XLogP of 2.70, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(2-methoxyethyl)-4-oxoquinazolin-6-yl]-3-(3-methoxyphenyl)urea is sourced from PubChem (CID 162429378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).