(4S,5R)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one;(4R,5S)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one;(4S,5S)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one

C75H72Cl6N6O9 — CID 160774429

IUPAC(4S,5R)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one;(4R,5S)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one;(4S,5S)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one
SMILESCOC[C@@]1(C)N(c2ccc(Cl)cc2)C(=O)N(c2ccc(Cl)cc2)[C@]1(O)c1cccc(C)c1.COC[C@]1(C)N(c2ccc(Cl)cc2)C(=O)N(c2ccc(Cl)cc2)[C@@]1(O)c1cccc(C)c1.COC[C@]1(C)N(c2ccc(Cl)cc2)C(=O)N(c2ccc(Cl)cc2)[C@]1(O)c1cccc(C)c1
InChIInChI=1S/3C25H24Cl2N2O3/c3*1-17-5-4-6-18(15-17)25(31)24(2,16-32-3)28(21-11-7-19(26)8-12-21)23(30)29(25)22-13-9-20(27)10-14-22/h3*4-15,31H,16H2,1-3H3/t2*24-,25+;24-,25-/m100/s1
InChIKeyRZTHGVGQYJZLDE-UDQUYSSXSA-N
MW1414.15 g/mol
LogP18.00
Rot. Bonds15

About (4S,5R)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one;(4R,5S)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one;(4S,5S)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one

(4S,5R)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one;(4R,5S)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one;(4S,5S)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one (PubChem CID 160774429) has the molecular formula C75H72Cl6N6O9 and a molecular weight of 1414.15 g/mol. Its IUPAC name is (4S,5R)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one;(4R,5S)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one;(4S,5S)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one.

Molecular Properties

Compound Name(4S,5R)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one;(4R,5S)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one;(4S,5S)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one
PubChem CID160774429
Molecular FormulaC75H72Cl6N6O9
Molecular Weight1414.15 g/mol
Exact Mass1410.35
IUPAC Name(4S,5R)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one;(4R,5S)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one;(4S,5S)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one
SMILESCOC[C@@]1(C)N(c2ccc(Cl)cc2)C(=O)N(c2ccc(Cl)cc2)[C@]1(O)c1cccc(C)c1.COC[C@]1(C)N(c2ccc(Cl)cc2)C(=O)N(c2ccc(Cl)cc2)[C@@]1(O)c1cccc(C)c1.COC[C@]1(C)N(c2ccc(Cl)cc2)C(=O)N(c2ccc(Cl)cc2)[C@]1(O)c1cccc(C)c1
InChIInChI=1S/3C25H24Cl2N2O3/c3*1-17-5-4-6-18(15-17)25(31)24(2,16-32-3)28(21-11-7-19(26)8-12-21)23(30)29(25)22-13-9-20(27)10-14-22/h3*4-15,31H,16H2,1-3H3/t2*24-,25+;24-,25-/m100/s1
InChIKeyRZTHGVGQYJZLDE-UDQUYSSXSA-N
XLogP18.00
TPSA159.03 Ų
H-Bond Donors3
H-Bond Acceptors9
Rotatable Bonds15
Heavy Atoms96
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001414.15
LogP ≤ 518.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 109

Analyze (4S,5R)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one;(4R,5S)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one;(4S,5S)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one with MolForge

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Related Compounds

(4R,5S)-1,3-bis(4-chlorophenyl)-4-hydroxy-4-(3-methylphenyl)-7-oxa-1,3-diazaspiro[4.4]nonan-2-one
CID 157224478
1,3-bis(3-chlorophenyl)-4-hydroxy-5,5-dimethyl-4-(3-methylphenyl)imidazolidin-2-one
CID 161144406
4-[5-ethyl-4-hydroxy-3-(4-isocyanophenyl)-5-methyl-4-(3-methylphenyl)-2-oxoimidazolidin-1-yl]benzonitrile
CID 158539471
(5S)-1,3-bis(4-chlorophenyl)-5-cyclobutyl-4-hydroxy-4-(3-methylphenyl)imidazolidin-2-one
CID 158758797
4-hydroxy-4-(3-isocyanophenyl)-1-(4-methoxyphenyl)-5,5-dimethyl-3-(4-methylphenyl)imidazolidin-2-one
CID 158972317
3-[3-(4-chlorophenyl)-5-ethyl-4-hydroxy-5-methyl-1-(4-methylphenyl)-2-oxoimidazolidin-4-yl]cyclohexa-1,3-diene-1-carbonitrile
CID 145417220
1-(4-chlorophenyl)-4-(methoxymethyl)-4-methyl-3-(4-methylphenyl)-5-[3-(trifluoromethoxy)phenyl]imidazolidin-2-one
CID 145417064
4-[8-hydroxy-7-(4-isocyanophenyl)-8-(3-methylphenyl)-6-oxo-5,7-diazaspiro[3.4]octan-5-yl]benzonitrile
CID 158439238
(4R,5R)-1,3-bis(4-chlorophenyl)-4-methyl-5-(3-methylphenyl)-4-(trifluoromethyl)imidazolidin-2-one
CID 157146502
2-[3-(4-chlorophenyl)-2,5-dioxo-4,4-diphenylimidazolidin-1-yl]acetic acid
CID 21155109
1,3-bis(4-chlorophenyl)-7a-(3-methylphenyl)-4,5,6,7-tetrahydro-3aH-benzimidazol-2-one;1,3-bis(4-chlorophenyl)-1,3-diazaspiro[4.4]nonane-2,4-dione;1,3-bis(4-chlorophenyl)-4-hydroxy-4-(3-methylphenyl)-1,3-diazaspiro[4.4]nonan-2-one;bis(1,3-bis(4-chlorophenyl)-4-(3-methylphenyl)-1,3-diazaspiro[4.4]nonan-2-one);1-bromo-3-methylbenzene
CID 157086229
N-(4-chlorophenyl)-3-(3-methylphenoxy)propanamide
CID 7965845

Frequently Asked Questions

What is the IUPAC name of (4S,5R)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one;(4R,5S)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one;(4S,5S)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one?
The IUPAC name of (4S,5R)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one;(4R,5S)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one;(4S,5S)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one (CID 160774429) is (4S,5R)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one;(4R,5S)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one;(4S,5S)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one.
What is the SMILES notation for (4S,5R)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one;(4R,5S)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one;(4S,5S)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one?
The canonical SMILES for (4S,5R)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one;(4R,5S)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one;(4S,5S)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one is COC[C@@]1(C)N(c2ccc(Cl)cc2)C(=O)N(c2ccc(Cl)cc2)[C@]1(O)c1cccc(C)c1.COC[C@]1(C)N(c2ccc(Cl)cc2)C(=O)N(c2ccc(Cl)cc2)[C@@]1(O)c1cccc(C)c1.COC[C@]1(C)N(c2ccc(Cl)cc2)C(=O)N(c2ccc(Cl)cc2)[C@]1(O)c1cccc(C)c1.
What is the InChIKey of (4S,5R)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one;(4R,5S)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one;(4S,5S)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one?
The InChIKey is RZTHGVGQYJZLDE-UDQUYSSXSA-N. The full InChI is InChI=1S/3C25H24Cl2N2O3/c3*1-17-5-4-6-18(15-17)25(31)24(2,16-32-3)28(21-11-7-19(26)8-12-21)23(30)29(25)22-13-9-20(27)10-14-22/h3*4-15,31H,16H2,1-3H3/t2*24-,25+;24-,25-/m100/s1.
What are the key properties of (4S,5R)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one;(4R,5S)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one;(4S,5S)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one?
(4S,5R)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one;(4R,5S)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one;(4S,5S)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one has a molecular weight of 1414.15 g/mol, XLogP of 18.00, 15 rotatable bonds, 3 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for (4S,5R)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one;(4R,5S)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one;(4S,5S)-1,3-bis(4-chlorophenyl)-4-hydroxy-5-(methoxymethyl)-5-methyl-4-(3-methylphenyl)imidazolidin-2-one is sourced from PubChem (CID 160774429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).