methyl 4-[hydroxy-[2-[(2-methoxybenzoyl)amino]phenyl]methyl]benzoate

C23H21NO5 — CID 71596281

IUPACmethyl 4-[hydroxy-[2-[(2-methoxybenzoyl)amino]phenyl]methyl]benzoate
SMILESCOC(=O)c1ccc(C(O)c2ccccc2NC(=O)c2ccccc2OC)cc1
InChIInChI=1S/C23H21NO5/c1-28-20-10-6-4-8-18(20)22(26)24-19-9-5-3-7-17(19)21(25)15-11-13-16(14-12-15)23(27)29-2/h3-14,21,25H,1-2H3,(H,24,26)
InChIKeyOKXOGFWZYFHOSQ-UHFFFAOYSA-N
MW391.42 g/mol
LogP3.82
Rot. Bonds6

About methyl 4-[hydroxy-[2-[(2-methoxybenzoyl)amino]phenyl]methyl]benzoate

methyl 4-[hydroxy-[2-[(2-methoxybenzoyl)amino]phenyl]methyl]benzoate (PubChem CID 71596281) has the molecular formula C23H21NO5 and a molecular weight of 391.42 g/mol. Its IUPAC name is methyl 4-[hydroxy-[2-[(2-methoxybenzoyl)amino]phenyl]methyl]benzoate.

Molecular Properties

Compound Namemethyl 4-[hydroxy-[2-[(2-methoxybenzoyl)amino]phenyl]methyl]benzoate
PubChem CID71596281
Molecular FormulaC23H21NO5
Molecular Weight391.42 g/mol
Exact Mass391.14
IUPAC Namemethyl 4-[hydroxy-[2-[(2-methoxybenzoyl)amino]phenyl]methyl]benzoate
SMILESCOC(=O)c1ccc(C(O)c2ccccc2NC(=O)c2ccccc2OC)cc1
InChIInChI=1S/C23H21NO5/c1-28-20-10-6-4-8-18(20)22(26)24-19-9-5-3-7-17(19)21(25)15-11-13-16(14-12-15)23(27)29-2/h3-14,21,25H,1-2H3,(H,24,26)
InChIKeyOKXOGFWZYFHOSQ-UHFFFAOYSA-N
XLogP3.82
TPSA84.86 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.42
LogP ≤ 53.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze methyl 4-[hydroxy-[2-[(2-methoxybenzoyl)amino]phenyl]methyl]benzoate 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

N-[2-[hydroxy-(4-nitrophenyl)methyl]phenyl]-2-methoxybenzamide
CID 71595967
N-[4-chloro-2-[(S)-hydroxy(phenyl)methyl]phenyl]-2-methoxybenzamide
CID 95557632
methyl 4-[(2-methoxybenzoyl)amino]-3-methylbenzoate
CID 36928114
methyl 4-chloro-3-[(2-methoxybenzoyl)amino]benzoate
CID 926199
N-(2-acetamidophenyl)-2-methoxybenzamide
CID 113093661
N-[2-[(S)-hydroxy(phenyl)methyl]phenyl]-4-methylbenzamide
CID 99639437
methyl 4-(2-methoxybenzoyl)benzoate
CID 22408243
methyl 4-[hydroxy(naphthalen-1-yl)methyl]benzoate
CID 46217309
N-[2-[2,2-difluoro-1-hydroxy-3-oxo-3-(propan-2-ylamino)propyl]phenyl]-2-methoxybenzamide
CID 18752827
2-methoxy-N-(2-prop-1-en-2-ylphenyl)benzamide
CID 175134678
methyl 2-[(2-methoxybenzoyl)amino]-5-[(2-methoxyphenyl)carbamoyl]-4-methylthiophene-3-carboxylate
CID 1131134
N-[2-(difluoromethylsulfanyl)phenyl]-2-methoxybenzamide
CID 26181019

Frequently Asked Questions

What is the IUPAC name of methyl 4-[hydroxy-[2-[(2-methoxybenzoyl)amino]phenyl]methyl]benzoate?
The IUPAC name of methyl 4-[hydroxy-[2-[(2-methoxybenzoyl)amino]phenyl]methyl]benzoate (CID 71596281) is methyl 4-[hydroxy-[2-[(2-methoxybenzoyl)amino]phenyl]methyl]benzoate.
What is the SMILES notation for methyl 4-[hydroxy-[2-[(2-methoxybenzoyl)amino]phenyl]methyl]benzoate?
The canonical SMILES for methyl 4-[hydroxy-[2-[(2-methoxybenzoyl)amino]phenyl]methyl]benzoate is COC(=O)c1ccc(C(O)c2ccccc2NC(=O)c2ccccc2OC)cc1.
What is the InChIKey of methyl 4-[hydroxy-[2-[(2-methoxybenzoyl)amino]phenyl]methyl]benzoate?
The InChIKey is OKXOGFWZYFHOSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21NO5/c1-28-20-10-6-4-8-18(20)22(26)24-19-9-5-3-7-17(19)21(25)15-11-13-16(14-12-15)23(27)29-2/h3-14,21,25H,1-2H3,(H,24,26).
What are the key properties of methyl 4-[hydroxy-[2-[(2-methoxybenzoyl)amino]phenyl]methyl]benzoate?
methyl 4-[hydroxy-[2-[(2-methoxybenzoyl)amino]phenyl]methyl]benzoate has a molecular weight of 391.42 g/mol, XLogP of 3.82, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 4-[hydroxy-[2-[(2-methoxybenzoyl)amino]phenyl]methyl]benzoate is sourced from PubChem (CID 71596281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).