1-(7-hydroxynaphthalen-1-yl)-3-(4-phenoxyphenyl)urea

C23H18N2O3 — CID 10133734

IUPAC1-(7-hydroxynaphthalen-1-yl)-3-(4-phenoxyphenyl)urea
SMILESO=C(Nc1ccc(Oc2ccccc2)cc1)Nc1cccc2ccc(O)cc12
InChIInChI=1S/C23H18N2O3/c26-18-12-9-16-5-4-8-22(21(16)15-18)25-23(27)24-17-10-13-20(14-11-17)28-19-6-2-1-3-7-19/h1-15,26H,(H2,24,25,27)
InChIKeyBEWBRYIDOSDRIG-UHFFFAOYSA-N
MW370.41 g/mol
LogP5.98
Rot. Bonds4

About 1-(7-hydroxynaphthalen-1-yl)-3-(4-phenoxyphenyl)urea

1-(7-hydroxynaphthalen-1-yl)-3-(4-phenoxyphenyl)urea (PubChem CID 10133734) has the molecular formula C23H18N2O3 and a molecular weight of 370.41 g/mol. Its IUPAC name is 1-(7-hydroxynaphthalen-1-yl)-3-(4-phenoxyphenyl)urea.

Molecular Properties

Compound Name1-(7-hydroxynaphthalen-1-yl)-3-(4-phenoxyphenyl)urea
PubChem CID10133734
Molecular FormulaC23H18N2O3
Molecular Weight370.41 g/mol
Exact Mass370.13
IUPAC Name1-(7-hydroxynaphthalen-1-yl)-3-(4-phenoxyphenyl)urea
SMILESO=C(Nc1ccc(Oc2ccccc2)cc1)Nc1cccc2ccc(O)cc12
InChIInChI=1S/C23H18N2O3/c26-18-12-9-16-5-4-8-22(21(16)15-18)25-23(27)24-17-10-13-20(14-11-17)28-19-6-2-1-3-7-19/h1-15,26H,(H2,24,25,27)
InChIKeyBEWBRYIDOSDRIG-UHFFFAOYSA-N
XLogP5.98
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.41
LogP ≤ 55.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-(7-hydroxynaphthalen-1-yl)-3-naphthalen-2-ylurea
CID 90803525
1-(3,4-dichlorophenyl)-3-(7-hydroxynaphthalen-1-yl)urea
CID 54581582
1-(3,5-dichlorophenyl)-3-(7-hydroxynaphthalen-1-yl)urea
CID 54586433
1-(6-hydroxynaphthalen-1-yl)-3-naphthalen-2-ylurea
CID 91060621
1-(7-hydroxynaphthalen-1-yl)-3-(3-methylphenyl)urea
CID 54581579
1-naphthalen-1-yl-3-[4-(naphthalen-1-ylcarbamoylamino)phenyl]urea
CID 23966866
1-naphthalen-1-yl-3-[3-[[4-[4-[[3-(naphthalen-1-ylcarbamoylamino)phenyl]sulfonylcarbamoylamino]phenoxy]phenyl]carbamoylsulfamoyl]phenyl]urea
CID 139806277
3-hydroxy-N-(7-hydroxynaphthalen-1-yl)naphthalene-2-carboxamide
CID 21402830
1-(4-butoxyphenyl)-3-naphthalen-1-ylurea
CID 4146159
1-(3,5-dibromo-4-hydroxyphenyl)-3-naphthalen-1-ylurea
CID 69011660
2-amino-N-(7-hydroxynaphthalen-1-yl)propanamide
CID 18475864
N-(7-hydroxynaphthalen-1-yl)-2-(2-methoxyphenyl)acetamide
CID 11209005

Frequently Asked Questions

What is the IUPAC name of 1-(7-hydroxynaphthalen-1-yl)-3-(4-phenoxyphenyl)urea?
The IUPAC name of 1-(7-hydroxynaphthalen-1-yl)-3-(4-phenoxyphenyl)urea (CID 10133734) is 1-(7-hydroxynaphthalen-1-yl)-3-(4-phenoxyphenyl)urea.
What is the SMILES notation for 1-(7-hydroxynaphthalen-1-yl)-3-(4-phenoxyphenyl)urea?
The canonical SMILES for 1-(7-hydroxynaphthalen-1-yl)-3-(4-phenoxyphenyl)urea is O=C(Nc1ccc(Oc2ccccc2)cc1)Nc1cccc2ccc(O)cc12.
What is the InChIKey of 1-(7-hydroxynaphthalen-1-yl)-3-(4-phenoxyphenyl)urea?
The InChIKey is BEWBRYIDOSDRIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N2O3/c26-18-12-9-16-5-4-8-22(21(16)15-18)25-23(27)24-17-10-13-20(14-11-17)28-19-6-2-1-3-7-19/h1-15,26H,(H2,24,25,27).
What are the key properties of 1-(7-hydroxynaphthalen-1-yl)-3-(4-phenoxyphenyl)urea?
1-(7-hydroxynaphthalen-1-yl)-3-(4-phenoxyphenyl)urea has a molecular weight of 370.41 g/mol, XLogP of 5.98, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-hydroxynaphthalen-1-yl)-3-(4-phenoxyphenyl)urea is sourced from PubChem (CID 10133734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).