1-(2-fluorophenyl)-3-[3-[(2-fluorophenyl)sulfamoyl]phenyl]urea

C19H15F2N3O3S — CID 4803235

IUPAC1-(2-fluorophenyl)-3-[3-[(2-fluorophenyl)sulfamoyl]phenyl]urea
SMILESO=C(Nc1cccc(S(=O)(=O)Nc2ccccc2F)c1)Nc1ccccc1F
InChIInChI=1S/C19H15F2N3O3S/c20-15-8-1-3-10-17(15)23-19(25)22-13-6-5-7-14(12-13)28(26,27)24-18-11-4-2-9-16(18)21/h1-12,24H,(H2,22,23,25)
InChIKeyMYCQEHAGTROZRU-UHFFFAOYSA-N
MW403.41 g/mol
LogP4.41
Rot. Bonds5

About 1-(2-fluorophenyl)-3-[3-[(2-fluorophenyl)sulfamoyl]phenyl]urea

1-(2-fluorophenyl)-3-[3-[(2-fluorophenyl)sulfamoyl]phenyl]urea (PubChem CID 4803235) has the molecular formula C19H15F2N3O3S and a molecular weight of 403.41 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-3-[3-[(2-fluorophenyl)sulfamoyl]phenyl]urea.

Molecular Properties

Compound Name1-(2-fluorophenyl)-3-[3-[(2-fluorophenyl)sulfamoyl]phenyl]urea
PubChem CID4803235
Molecular FormulaC19H15F2N3O3S
Molecular Weight403.41 g/mol
Exact Mass403.08
IUPAC Name1-(2-fluorophenyl)-3-[3-[(2-fluorophenyl)sulfamoyl]phenyl]urea
SMILESO=C(Nc1cccc(S(=O)(=O)Nc2ccccc2F)c1)Nc1ccccc1F
InChIInChI=1S/C19H15F2N3O3S/c20-15-8-1-3-10-17(15)23-19(25)22-13-6-5-7-14(12-13)28(26,27)24-18-11-4-2-9-16(18)21/h1-12,24H,(H2,22,23,25)
InChIKeyMYCQEHAGTROZRU-UHFFFAOYSA-N
XLogP4.41
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.41
LogP ≤ 54.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 26537969
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2-chloro-N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-6-fluorobenzamide
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N-ethyl-3-[[3-[(2-fluorophenyl)sulfamoyl]benzoyl]amino]benzamide
CID 55406945
3-[(2-fluorophenyl)sulfamoyl]-N-(4-iodophenyl)benzamide
CID 42992510
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CID 4826830
1-[3-[(2-fluorophenyl)sulfamoyl]phenyl]-3-(furan-2-ylmethyl)thiourea
CID 8614305
1-[3-[(3-bromophenyl)sulfonylamino]phenyl]-3-phenylurea
CID 24622073
1-[3-(3,4-dihydro-2H-pyrrol-1-ium-5-ylsulfamoyl)phenyl]-3-phenylurea
CID 9452295
1-[2-[(4-chlorophenyl)sulfonylamino]phenyl]-3-phenylurea
CID 16615674
1-(2-fluorophenyl)-3-[3-(methylaminomethyl)phenyl]urea
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N-[[3-[(2-propylphenyl)sulfamoyl]phenyl]carbamoyl]propanamide
CID 66576050

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-3-[3-[(2-fluorophenyl)sulfamoyl]phenyl]urea?
The IUPAC name of 1-(2-fluorophenyl)-3-[3-[(2-fluorophenyl)sulfamoyl]phenyl]urea (CID 4803235) is 1-(2-fluorophenyl)-3-[3-[(2-fluorophenyl)sulfamoyl]phenyl]urea.
What is the SMILES notation for 1-(2-fluorophenyl)-3-[3-[(2-fluorophenyl)sulfamoyl]phenyl]urea?
The canonical SMILES for 1-(2-fluorophenyl)-3-[3-[(2-fluorophenyl)sulfamoyl]phenyl]urea is O=C(Nc1cccc(S(=O)(=O)Nc2ccccc2F)c1)Nc1ccccc1F.
What is the InChIKey of 1-(2-fluorophenyl)-3-[3-[(2-fluorophenyl)sulfamoyl]phenyl]urea?
The InChIKey is MYCQEHAGTROZRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15F2N3O3S/c20-15-8-1-3-10-17(15)23-19(25)22-13-6-5-7-14(12-13)28(26,27)24-18-11-4-2-9-16(18)21/h1-12,24H,(H2,22,23,25).
What are the key properties of 1-(2-fluorophenyl)-3-[3-[(2-fluorophenyl)sulfamoyl]phenyl]urea?
1-(2-fluorophenyl)-3-[3-[(2-fluorophenyl)sulfamoyl]phenyl]urea has a molecular weight of 403.41 g/mol, XLogP of 4.41, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-3-[3-[(2-fluorophenyl)sulfamoyl]phenyl]urea is sourced from PubChem (CID 4803235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).