ethyl N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]carbamate

C16H18N2O5S — CID 7908123

IUPACethyl N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]carbamate
SMILESCCOC(=O)Nc1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1
InChIInChI=1S/C16H18N2O5S/c1-3-23-16(19)17-13-5-4-6-15(11-13)24(20,21)18-12-7-9-14(22-2)10-8-12/h4-11,18H,3H2,1-2H3,(H,17,19)
InChIKeyABVCXWDRNSTBSC-UHFFFAOYSA-N
MW350.40 g/mol
LogP3.06
Rot. Bonds6

About ethyl N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]carbamate

ethyl N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]carbamate (PubChem CID 7908123) has the molecular formula C16H18N2O5S and a molecular weight of 350.40 g/mol. Its IUPAC name is ethyl N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]carbamate.

Molecular Properties

Compound Nameethyl N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]carbamate
PubChem CID7908123
Molecular FormulaC16H18N2O5S
Molecular Weight350.40 g/mol
Exact Mass350.09
IUPAC Nameethyl N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]carbamate
SMILESCCOC(=O)Nc1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1
InChIInChI=1S/C16H18N2O5S/c1-3-23-16(19)17-13-5-4-6-15(11-13)24(20,21)18-12-7-9-14(22-2)10-8-12/h4-11,18H,3H2,1-2H3,(H,17,19)
InChIKeyABVCXWDRNSTBSC-UHFFFAOYSA-N
XLogP3.06
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.40
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(carbamoylamino)-N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]acetamide
CID 18168699
1-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]-3-propylurea
CID 4803273
N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]-3,3-dimethylbutanamide
CID 38765461
N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]benzamide
CID 4213453
3-methoxy-N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]benzamide
CID 5156929
ethyl (E)-2-cyano-3-[3-[(4-methoxyphenyl)sulfamoyl]anilino]prop-2-enoate
CID 8811221
2-cyclopentyl-N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]acetamide
CID 9414196
ethyl N-[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]carbamate
CID 17147479
N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]-3-(2-methylphenoxy)propanamide
CID 24639796
N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]-2-phenoxypropanamide
CID 24639819
1-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]-3-(4-nitrophenyl)urea
CID 3500250
4-(2,5-dimethylthiophen-3-yl)-N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]-4-oxobutanamide
CID 24639800

Frequently Asked Questions

What is the IUPAC name of ethyl N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]carbamate?
The IUPAC name of ethyl N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]carbamate (CID 7908123) is ethyl N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]carbamate.
What is the SMILES notation for ethyl N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]carbamate?
The canonical SMILES for ethyl N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]carbamate is CCOC(=O)Nc1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1.
What is the InChIKey of ethyl N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]carbamate?
The InChIKey is ABVCXWDRNSTBSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O5S/c1-3-23-16(19)17-13-5-4-6-15(11-13)24(20,21)18-12-7-9-14(22-2)10-8-12/h4-11,18H,3H2,1-2H3,(H,17,19).
What are the key properties of ethyl N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]carbamate?
ethyl N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]carbamate has a molecular weight of 350.40 g/mol, XLogP of 3.06, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]carbamate is sourced from PubChem (CID 7908123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).