[2-[(4-methoxybenzoyl)amino]-2-oxoethyl] 5-sulfamoylfuran-2-carboxylate

C15H14N2O8S — CID 55643755

IUPAC[2-[(4-methoxybenzoyl)amino]-2-oxoethyl] 5-sulfamoylfuran-2-carboxylate
SMILESCOc1ccc(C(=O)NC(=O)COC(=O)c2ccc(S(N)(=O)=O)o2)cc1
InChIInChI=1S/C15H14N2O8S/c1-23-10-4-2-9(3-5-10)14(19)17-12(18)8-24-15(20)11-6-7-13(25-11)26(16,21)22/h2-7H,8H2,1H3,(H2,16,21,22)(H,17,18,19)
InChIKeyWVSKMHUPVLOVTN-UHFFFAOYSA-N
MW382.35 g/mol
LogP0.05
Rot. Bonds6

About [2-[(4-methoxybenzoyl)amino]-2-oxoethyl] 5-sulfamoylfuran-2-carboxylate

[2-[(4-methoxybenzoyl)amino]-2-oxoethyl] 5-sulfamoylfuran-2-carboxylate (PubChem CID 55643755) has the molecular formula C15H14N2O8S and a molecular weight of 382.35 g/mol. Its IUPAC name is [2-[(4-methoxybenzoyl)amino]-2-oxoethyl] 5-sulfamoylfuran-2-carboxylate.

Molecular Properties

Compound Name[2-[(4-methoxybenzoyl)amino]-2-oxoethyl] 5-sulfamoylfuran-2-carboxylate
PubChem CID55643755
Molecular FormulaC15H14N2O8S
Molecular Weight382.35 g/mol
Exact Mass382.05
IUPAC Name[2-[(4-methoxybenzoyl)amino]-2-oxoethyl] 5-sulfamoylfuran-2-carboxylate
SMILESCOc1ccc(C(=O)NC(=O)COC(=O)c2ccc(S(N)(=O)=O)o2)cc1
InChIInChI=1S/C15H14N2O8S/c1-23-10-4-2-9(3-5-10)14(19)17-12(18)8-24-15(20)11-6-7-13(25-11)26(16,21)22/h2-7H,8H2,1H3,(H2,16,21,22)(H,17,18,19)
InChIKeyWVSKMHUPVLOVTN-UHFFFAOYSA-N
XLogP0.05
TPSA155.00 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.35
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze [2-[(4-methoxybenzoyl)amino]-2-oxoethyl] 5-sulfamoylfuran-2-carboxylate 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

[2-(4-methoxyanilino)-2-oxoethyl] 5-sulfamoylfuran-2-carboxylate
CID 55644085
(4-methoxycarbonylphenyl)methyl 5-sulfamoylfuran-2-carboxylate
CID 46426101
[2-(4-acetamidoanilino)-2-oxoethyl] 5-sulfamoylfuran-2-carboxylate
CID 55643941
[2-(4-methylanilino)-2-oxoethyl] 5-sulfamoylfuran-2-carboxylate
CID 46426057
[2-[(4-methoxybenzoyl)amino]-2-oxoethyl] 2,3-dihydro-1,4-benzodioxine-6-carboxylate
CID 16530725
[2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoylamino)-2-oxoethyl] 5-sulfamoylfuran-2-carboxylate
CID 55643754
[2-[(4-methoxybenzoyl)amino]-2-oxoethyl] 4-morpholin-4-ylsulfonylbenzoate
CID 16527597
phenacyl 5-sulfamoylfuran-2-carboxylate
CID 46426116
[2-(2-acetylanilino)-2-oxoethyl] 5-sulfamoylfuran-2-carboxylate
CID 55643937
[2-(2-methoxy-4-nitroanilino)-2-oxoethyl] 5-sulfamoylfuran-2-carboxylate
CID 55644003
[2-[[4-(difluoromethoxy)benzoyl]amino]-2-oxoethyl] 5-(4-fluorophenyl)furan-2-carboxylate
CID 43026963
[2-[(3-fluoro-4-methylphenyl)methylamino]-2-oxoethyl] 5-sulfamoylfuran-2-carboxylate
CID 55643918

Frequently Asked Questions

What is the IUPAC name of [2-[(4-methoxybenzoyl)amino]-2-oxoethyl] 5-sulfamoylfuran-2-carboxylate?
The IUPAC name of [2-[(4-methoxybenzoyl)amino]-2-oxoethyl] 5-sulfamoylfuran-2-carboxylate (CID 55643755) is [2-[(4-methoxybenzoyl)amino]-2-oxoethyl] 5-sulfamoylfuran-2-carboxylate.
What is the SMILES notation for [2-[(4-methoxybenzoyl)amino]-2-oxoethyl] 5-sulfamoylfuran-2-carboxylate?
The canonical SMILES for [2-[(4-methoxybenzoyl)amino]-2-oxoethyl] 5-sulfamoylfuran-2-carboxylate is COc1ccc(C(=O)NC(=O)COC(=O)c2ccc(S(N)(=O)=O)o2)cc1.
What is the InChIKey of [2-[(4-methoxybenzoyl)amino]-2-oxoethyl] 5-sulfamoylfuran-2-carboxylate?
The InChIKey is WVSKMHUPVLOVTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O8S/c1-23-10-4-2-9(3-5-10)14(19)17-12(18)8-24-15(20)11-6-7-13(25-11)26(16,21)22/h2-7H,8H2,1H3,(H2,16,21,22)(H,17,18,19).
What are the key properties of [2-[(4-methoxybenzoyl)amino]-2-oxoethyl] 5-sulfamoylfuran-2-carboxylate?
[2-[(4-methoxybenzoyl)amino]-2-oxoethyl] 5-sulfamoylfuran-2-carboxylate has a molecular weight of 382.35 g/mol, XLogP of 0.05, 6 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(4-methoxybenzoyl)amino]-2-oxoethyl] 5-sulfamoylfuran-2-carboxylate is sourced from PubChem (CID 55643755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).