1-[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]-3-(2,4-dichlorophenyl)urea

C15H13Cl3N2O2 — CID 51944288

IUPAC1-[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]-3-(2,4-dichlorophenyl)urea
SMILESO=C(NC[C@H](O)c1cccc(Cl)c1)Nc1ccc(Cl)cc1Cl
InChIInChI=1S/C15H13Cl3N2O2/c16-10-3-1-2-9(6-10)14(21)8-19-15(22)20-13-5-4-11(17)7-12(13)18/h1-7,14,21H,8H2,(H2,19,20,22)/t14-/m0/s1
InChIKeyDIWFUTYSTWJGPN-AWEZNQCLSA-N
MW359.64 g/mol
LogP4.50
Rot. Bonds4

About 1-[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]-3-(2,4-dichlorophenyl)urea

1-[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]-3-(2,4-dichlorophenyl)urea (PubChem CID 51944288) has the molecular formula C15H13Cl3N2O2 and a molecular weight of 359.64 g/mol. Its IUPAC name is 1-[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]-3-(2,4-dichlorophenyl)urea.

Molecular Properties

Compound Name1-[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]-3-(2,4-dichlorophenyl)urea
PubChem CID51944288
Molecular FormulaC15H13Cl3N2O2
Molecular Weight359.64 g/mol
Exact Mass358.00
IUPAC Name1-[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]-3-(2,4-dichlorophenyl)urea
SMILESO=C(NC[C@H](O)c1cccc(Cl)c1)Nc1ccc(Cl)cc1Cl
InChIInChI=1S/C15H13Cl3N2O2/c16-10-3-1-2-9(6-10)14(21)8-19-15(22)20-13-5-4-11(17)7-12(13)18/h1-7,14,21H,8H2,(H2,19,20,22)/t14-/m0/s1
InChIKeyDIWFUTYSTWJGPN-AWEZNQCLSA-N
XLogP4.50
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.64
LogP ≤ 54.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,4-dichlorophenyl)-3-[2-(4-fluorophenyl)-2-hydroxyethyl]urea
CID 75876358
1-(3-chloro-4-fluorophenyl)-3-[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]urea
CID 51944513
1-[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]-3-(2,5-dimethylphenyl)urea
CID 51943967
1-[2-(3-chlorophenyl)-2-hydroxyethyl]-3-(4-fluorophenyl)urea
CID 42960515
1-(4-acetylphenyl)-3-[2-(3-chlorophenyl)-2-hydroxyethyl]urea
CID 42960513
1-(3-chloro-4-cyanophenyl)-3-[(2S)-2-(3-chlorophenyl)-2-hydroxyethyl]urea
CID 51945011
1-[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]-3-(3,5-dimethoxyphenyl)urea
CID 51944524
1-[(2S)-2-(3-chlorophenyl)-2-hydroxyethyl]-3-(4-cyanophenyl)urea
CID 38282945
1-(2,4-dichlorophenyl)-3-(3,3-diphenylpropyl)urea
CID 4586942
1-[(2S)-2-(3-chlorophenyl)-2-hydroxyethyl]-3-(1,3-thiazol-2-yl)urea
CID 94024697
1-[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]-3-(5-methyl-1,2-oxazol-3-yl)urea
CID 38282989
1-[(2S)-2-(3-chlorophenyl)-2-hydroxyethyl]-3-[4-(difluoromethoxy)phenyl]urea
CID 51944880

Frequently Asked Questions

What is the IUPAC name of 1-[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]-3-(2,4-dichlorophenyl)urea?
The IUPAC name of 1-[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]-3-(2,4-dichlorophenyl)urea (CID 51944288) is 1-[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]-3-(2,4-dichlorophenyl)urea.
What is the SMILES notation for 1-[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]-3-(2,4-dichlorophenyl)urea?
The canonical SMILES for 1-[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]-3-(2,4-dichlorophenyl)urea is O=C(NC[C@H](O)c1cccc(Cl)c1)Nc1ccc(Cl)cc1Cl.
What is the InChIKey of 1-[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]-3-(2,4-dichlorophenyl)urea?
The InChIKey is DIWFUTYSTWJGPN-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H13Cl3N2O2/c16-10-3-1-2-9(6-10)14(21)8-19-15(22)20-13-5-4-11(17)7-12(13)18/h1-7,14,21H,8H2,(H2,19,20,22)/t14-/m0/s1.
What are the key properties of 1-[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]-3-(2,4-dichlorophenyl)urea?
1-[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]-3-(2,4-dichlorophenyl)urea has a molecular weight of 359.64 g/mol, XLogP of 4.50, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]-3-(2,4-dichlorophenyl)urea is sourced from PubChem (CID 51944288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).