N-[3-chloro-5-(methanesulfonamido)phenyl]-4-(2-methoxyphenyl)thiophene-2-carboxamide

C19H17ClN2O4S2 — CID 169144492

IUPACN-[3-chloro-5-(methanesulfonamido)phenyl]-4-(2-methoxyphenyl)thiophene-2-carboxamide
SMILESCOc1ccccc1-c1csc(C(=O)Nc2cc(Cl)cc(NS(C)(=O)=O)c2)c1
InChIInChI=1S/C19H17ClN2O4S2/c1-26-17-6-4-3-5-16(17)12-7-18(27-11-12)19(23)21-14-8-13(20)9-15(10-14)22-28(2,24)25/h3-11,22H,1-2H3,(H,21,23)
InChIKeySLENIDPWBVNSST-UHFFFAOYSA-N
MW436.94 g/mol
LogP4.70
Rot. Bonds6

About N-[3-chloro-5-(methanesulfonamido)phenyl]-4-(2-methoxyphenyl)thiophene-2-carboxamide

N-[3-chloro-5-(methanesulfonamido)phenyl]-4-(2-methoxyphenyl)thiophene-2-carboxamide (PubChem CID 169144492) has the molecular formula C19H17ClN2O4S2 and a molecular weight of 436.94 g/mol. Its IUPAC name is N-[3-chloro-5-(methanesulfonamido)phenyl]-4-(2-methoxyphenyl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[3-chloro-5-(methanesulfonamido)phenyl]-4-(2-methoxyphenyl)thiophene-2-carboxamide
PubChem CID169144492
Molecular FormulaC19H17ClN2O4S2
Molecular Weight436.94 g/mol
Exact Mass436.03
IUPAC NameN-[3-chloro-5-(methanesulfonamido)phenyl]-4-(2-methoxyphenyl)thiophene-2-carboxamide
SMILESCOc1ccccc1-c1csc(C(=O)Nc2cc(Cl)cc(NS(C)(=O)=O)c2)c1
InChIInChI=1S/C19H17ClN2O4S2/c1-26-17-6-4-3-5-16(17)12-7-18(27-11-12)19(23)21-14-8-13(20)9-15(10-14)22-28(2,24)25/h3-11,22H,1-2H3,(H,21,23)
InChIKeySLENIDPWBVNSST-UHFFFAOYSA-N
XLogP4.70
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.94
LogP ≤ 54.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[3-chloro-5-(methanesulfonamido)phenyl]-4-(2-methoxyphenyl)thiophene-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[3-chloro-5-(methanesulfonamido)phenyl]-4-(2-methoxyphenyl)thiophene-2-carboxamide?
The IUPAC name of N-[3-chloro-5-(methanesulfonamido)phenyl]-4-(2-methoxyphenyl)thiophene-2-carboxamide (CID 169144492) is N-[3-chloro-5-(methanesulfonamido)phenyl]-4-(2-methoxyphenyl)thiophene-2-carboxamide.
What is the SMILES notation for N-[3-chloro-5-(methanesulfonamido)phenyl]-4-(2-methoxyphenyl)thiophene-2-carboxamide?
The canonical SMILES for N-[3-chloro-5-(methanesulfonamido)phenyl]-4-(2-methoxyphenyl)thiophene-2-carboxamide is COc1ccccc1-c1csc(C(=O)Nc2cc(Cl)cc(NS(C)(=O)=O)c2)c1.
What is the InChIKey of N-[3-chloro-5-(methanesulfonamido)phenyl]-4-(2-methoxyphenyl)thiophene-2-carboxamide?
The InChIKey is SLENIDPWBVNSST-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClN2O4S2/c1-26-17-6-4-3-5-16(17)12-7-18(27-11-12)19(23)21-14-8-13(20)9-15(10-14)22-28(2,24)25/h3-11,22H,1-2H3,(H,21,23).
What are the key properties of N-[3-chloro-5-(methanesulfonamido)phenyl]-4-(2-methoxyphenyl)thiophene-2-carboxamide?
N-[3-chloro-5-(methanesulfonamido)phenyl]-4-(2-methoxyphenyl)thiophene-2-carboxamide has a molecular weight of 436.94 g/mol, XLogP of 4.70, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-chloro-5-(methanesulfonamido)phenyl]-4-(2-methoxyphenyl)thiophene-2-carboxamide is sourced from PubChem (CID 169144492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).