1-(3,5-dichlorophenyl)-3-(7-hydroxynaphthalen-1-yl)urea

C17H12Cl2N2O2 — CID 54586433

IUPAC1-(3,5-dichlorophenyl)-3-(7-hydroxynaphthalen-1-yl)urea
SMILESO=C(Nc1cc(Cl)cc(Cl)c1)Nc1cccc2ccc(O)cc12
InChIInChI=1S/C17H12Cl2N2O2/c18-11-6-12(19)8-13(7-11)20-17(23)21-16-3-1-2-10-4-5-14(22)9-15(10)16/h1-9,22H,(H2,20,21,23)
InChIKeySALIMPNYBBNRBC-UHFFFAOYSA-N
MW347.20 g/mol
LogP5.50
Rot. Bonds2

About 1-(3,5-dichlorophenyl)-3-(7-hydroxynaphthalen-1-yl)urea

1-(3,5-dichlorophenyl)-3-(7-hydroxynaphthalen-1-yl)urea (PubChem CID 54586433) has the molecular formula C17H12Cl2N2O2 and a molecular weight of 347.20 g/mol. Its IUPAC name is 1-(3,5-dichlorophenyl)-3-(7-hydroxynaphthalen-1-yl)urea.

Molecular Properties

Compound Name1-(3,5-dichlorophenyl)-3-(7-hydroxynaphthalen-1-yl)urea
PubChem CID54586433
Molecular FormulaC17H12Cl2N2O2
Molecular Weight347.20 g/mol
Exact Mass346.03
IUPAC Name1-(3,5-dichlorophenyl)-3-(7-hydroxynaphthalen-1-yl)urea
SMILESO=C(Nc1cc(Cl)cc(Cl)c1)Nc1cccc2ccc(O)cc12
InChIInChI=1S/C17H12Cl2N2O2/c18-11-6-12(19)8-13(7-11)20-17(23)21-16-3-1-2-10-4-5-14(22)9-15(10)16/h1-9,22H,(H2,20,21,23)
InChIKeySALIMPNYBBNRBC-UHFFFAOYSA-N
XLogP5.50
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500347.20
LogP ≤ 55.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Analyze 1-(3,5-dichlorophenyl)-3-(7-hydroxynaphthalen-1-yl)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

1-(3,4-dichlorophenyl)-3-(7-hydroxynaphthalen-1-yl)urea
CID 54581582
1-(7-hydroxynaphthalen-1-yl)-3-naphthalen-2-ylurea
CID 90803525
1-(7-hydroxynaphthalen-1-yl)-3-(3-methylphenyl)urea
CID 54581579
1-(7-hydroxynaphthalen-1-yl)-3-(4-phenoxyphenyl)urea
CID 10133734
1-(6-hydroxynaphthalen-1-yl)-3-naphthalen-2-ylurea
CID 91060621
1-(3,5-dichlorophenyl)-3-(2-ethylphenyl)urea
CID 108991481
1-(2,4-dichloro-7-hydroxynaphthalen-1-yl)-3-(3,5-dichlorophenyl)urea
CID 91474575
2-amino-N-(7-hydroxynaphthalen-1-yl)propanamide
CID 18475864
1-(3,5-dichlorophenyl)-3-(2,6-dimethylphenyl)urea
CID 108991412
1-(7-hydroxynaphthalen-1-yl)-3-(1,3-thiazol-2-yl)urea
CID 5330590
2-amino-N-(7-hydroxynaphthalen-1-yl)acetamide;hydrochloride
CID 70150550
1-(4-chloro-2,6-dimethylphenyl)-3-naphthalen-1-ylurea
CID 3557641

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dichlorophenyl)-3-(7-hydroxynaphthalen-1-yl)urea?
The IUPAC name of 1-(3,5-dichlorophenyl)-3-(7-hydroxynaphthalen-1-yl)urea (CID 54586433) is 1-(3,5-dichlorophenyl)-3-(7-hydroxynaphthalen-1-yl)urea.
What is the SMILES notation for 1-(3,5-dichlorophenyl)-3-(7-hydroxynaphthalen-1-yl)urea?
The canonical SMILES for 1-(3,5-dichlorophenyl)-3-(7-hydroxynaphthalen-1-yl)urea is O=C(Nc1cc(Cl)cc(Cl)c1)Nc1cccc2ccc(O)cc12.
What is the InChIKey of 1-(3,5-dichlorophenyl)-3-(7-hydroxynaphthalen-1-yl)urea?
The InChIKey is SALIMPNYBBNRBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12Cl2N2O2/c18-11-6-12(19)8-13(7-11)20-17(23)21-16-3-1-2-10-4-5-14(22)9-15(10)16/h1-9,22H,(H2,20,21,23).
What are the key properties of 1-(3,5-dichlorophenyl)-3-(7-hydroxynaphthalen-1-yl)urea?
1-(3,5-dichlorophenyl)-3-(7-hydroxynaphthalen-1-yl)urea has a molecular weight of 347.20 g/mol, XLogP of 5.50, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dichlorophenyl)-3-(7-hydroxynaphthalen-1-yl)urea is sourced from PubChem (CID 54586433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).