1-(4-chlorophenyl)-3-[3-(3-methoxyphenyl)phenyl]urea

C20H17ClN2O2 — CID 135376155

IUPAC1-(4-chlorophenyl)-3-[3-(3-methoxyphenyl)phenyl]urea
SMILESCOc1cccc(-c2cccc(NC(=O)Nc3ccc(Cl)cc3)c2)c1
InChIInChI=1S/C20H17ClN2O2/c1-25-19-7-3-5-15(13-19)14-4-2-6-18(12-14)23-20(24)22-17-10-8-16(21)9-11-17/h2-13H,1H3,(H2,22,23,24)
InChIKeyMPIMPKUIJBYSNZ-UHFFFAOYSA-N
MW352.82 g/mol
LogP5.66
Rot. Bonds4

About 1-(4-chlorophenyl)-3-[3-(3-methoxyphenyl)phenyl]urea

1-(4-chlorophenyl)-3-[3-(3-methoxyphenyl)phenyl]urea (PubChem CID 135376155) has the molecular formula C20H17ClN2O2 and a molecular weight of 352.82 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-3-[3-(3-methoxyphenyl)phenyl]urea.

Molecular Properties

Compound Name1-(4-chlorophenyl)-3-[3-(3-methoxyphenyl)phenyl]urea
PubChem CID135376155
Molecular FormulaC20H17ClN2O2
Molecular Weight352.82 g/mol
Exact Mass352.10
IUPAC Name1-(4-chlorophenyl)-3-[3-(3-methoxyphenyl)phenyl]urea
SMILESCOc1cccc(-c2cccc(NC(=O)Nc3ccc(Cl)cc3)c2)c1
InChIInChI=1S/C20H17ClN2O2/c1-25-19-7-3-5-15(13-19)14-4-2-6-18(12-14)23-20(24)22-17-10-8-16(21)9-11-17/h2-13H,1H3,(H2,22,23,24)
InChIKeyMPIMPKUIJBYSNZ-UHFFFAOYSA-N
XLogP5.66
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500352.82
LogP ≤ 55.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-(4-chlorophenyl)-3-[3-(3-methoxyphenyl)phenyl]urea 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

AG-26
CID 727787
3-(4-chlorophenyl)-1-{3-[(1E)-2-(4-methoxyphenyl)ethenyl]phenyl}urea
CID 138393289
D-159687
CID 57703712
1-{3-[(3-Chloro-5-Methoxybenzyl)amino]propyl}-3-Phenylurea
CID 60195001
1-(4-Chloro-3-(trifluoromethyl)phenyl)-3-(7-methoxynaphthalen-1-yl)urea
CID 54585485
1-(4-Chloro-3-methoxy-phenyl)-3-[1-(3-isopropenylphenyl)-1-methyl-ethyl]urea
CID 71455424
1-(4-Chlorophenyl)-3-[2-(3-methoxyphenyl)ethyl]urea
CID 108868700
1-[3-(1,3-Benzodioxol-5-yl)phenyl]-3-(4-chlorophenyl)urea
CID 135376438
1-(4-Chlorophenyl)-3-[3-(3-hydroxyphenyl)phenyl]urea
CID 135376458
1-[5,5-Bis(4-methoxyphenyl)pentyl]-3-[4-chloro-3-(trifluoromethyl)phenyl]urea
CID 162652683
US10265310, Example 9
CID 145866697
US10265310, Example 45
CID 145866719

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-3-[3-(3-methoxyphenyl)phenyl]urea?
The IUPAC name of 1-(4-chlorophenyl)-3-[3-(3-methoxyphenyl)phenyl]urea (CID 135376155) is 1-(4-chlorophenyl)-3-[3-(3-methoxyphenyl)phenyl]urea.
What is the SMILES notation for 1-(4-chlorophenyl)-3-[3-(3-methoxyphenyl)phenyl]urea?
The canonical SMILES for 1-(4-chlorophenyl)-3-[3-(3-methoxyphenyl)phenyl]urea is COc1cccc(-c2cccc(NC(=O)Nc3ccc(Cl)cc3)c2)c1.
What is the InChIKey of 1-(4-chlorophenyl)-3-[3-(3-methoxyphenyl)phenyl]urea?
The InChIKey is MPIMPKUIJBYSNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17ClN2O2/c1-25-19-7-3-5-15(13-19)14-4-2-6-18(12-14)23-20(24)22-17-10-8-16(21)9-11-17/h2-13H,1H3,(H2,22,23,24).
What are the key properties of 1-(4-chlorophenyl)-3-[3-(3-methoxyphenyl)phenyl]urea?
1-(4-chlorophenyl)-3-[3-(3-methoxyphenyl)phenyl]urea has a molecular weight of 352.82 g/mol, XLogP of 5.66, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-3-[3-(3-methoxyphenyl)phenyl]urea is sourced from PubChem (CID 135376155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).