6-morpholin-4-yl-N-[5-(4-pyridin-4-ylquinolin-6-yl)-3-pyridinyl]pyridine-3-sulfonamide

C28H24N6O3S — CID 59859945

IUPAC6-morpholin-4-yl-N-[5-(4-pyridin-4-ylquinolin-6-yl)-3-pyridinyl]pyridine-3-sulfonamide
SMILESO=S(=O)(Nc1cncc(-c2ccc3nccc(-c4ccncc4)c3c2)c1)c1ccc(N2CCOCC2)nc1
InChIInChI=1S/C28H24N6O3S/c35-38(36,24-2-4-28(32-19-24)34-11-13-37-14-12-34)33-23-15-22(17-30-18-23)21-1-3-27-26(16-21)25(7-10-31-27)20-5-8-29-9-6-20/h1-10,15-19,33H,11-14H2
InChIKeyPXDDZCZMDLDRAO-UHFFFAOYSA-N
MW524.61 g/mol
LogP4.39
Rot. Bonds6

About 6-morpholin-4-yl-N-[5-(4-pyridin-4-ylquinolin-6-yl)-3-pyridinyl]pyridine-3-sulfonamide

6-morpholin-4-yl-N-[5-(4-pyridin-4-ylquinolin-6-yl)-3-pyridinyl]pyridine-3-sulfonamide (PubChem CID 59859945) has the molecular formula C28H24N6O3S and a molecular weight of 524.61 g/mol. Its IUPAC name is 6-morpholin-4-yl-N-[5-(4-pyridin-4-ylquinolin-6-yl)-3-pyridinyl]pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-morpholin-4-yl-N-[5-(4-pyridin-4-ylquinolin-6-yl)-3-pyridinyl]pyridine-3-sulfonamide
PubChem CID59859945
Molecular FormulaC28H24N6O3S
Molecular Weight524.61 g/mol
Exact Mass524.16
IUPAC Name6-morpholin-4-yl-N-[5-(4-pyridin-4-ylquinolin-6-yl)-3-pyridinyl]pyridine-3-sulfonamide
SMILESO=S(=O)(Nc1cncc(-c2ccc3nccc(-c4ccncc4)c3c2)c1)c1ccc(N2CCOCC2)nc1
InChIInChI=1S/C28H24N6O3S/c35-38(36,24-2-4-28(32-19-24)34-11-13-37-14-12-34)33-23-15-22(17-30-18-23)21-1-3-27-26(16-21)25(7-10-31-27)20-5-8-29-9-6-20/h1-10,15-19,33H,11-14H2
InChIKeyPXDDZCZMDLDRAO-UHFFFAOYSA-N
XLogP4.39
TPSA110.20 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500524.61
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 6-morpholin-4-yl-N-[5-(4-pyridin-4-ylquinolin-6-yl)-3-pyridinyl]pyridine-3-sulfonamide with MolForge

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Launch Full Analysis

Related Compounds

4-propan-2-yl-N-[5-(4-pyridin-4-ylquinolin-6-yl)-3-pyridinyl]benzenesulfonamide
CID 59860013
3,4-dimethoxy-N-[5-(4-pyridin-4-ylquinolin-6-yl)-3-pyridinyl]benzenesulfonamide
CID 59860200
2,3-dimethyl-N-[5-(4-pyridin-4-ylquinolin-6-yl)-3-pyridinyl]imidazole-4-sulfonamide
CID 59859999
5-(4-pyridin-4-ylquinolin-6-yl)pyridine-3-sulfonamide
CID 25121265
2-amino-N-pyridin-4-yl-5-(4-pyridin-4-ylquinolin-6-yl)pyridine-3-sulfonamide
CID 59860011
3-morpholin-4-ylsulfinyl-5-(4-pyridin-4-ylquinolin-6-yl)pyridin-2-amine
CID 69175357
N-[2-chloro-5-(4-morpholin-4-ylquinolin-6-yl)-3-pyridinyl]pyridine-3-sulfonamide
CID 58229517
4-(5-pyridin-4-yl-2-pyridinyl)morpholine
CID 10377044
6-morpholin-4-yl-N-propan-2-ylpyridine-3-sulfonamide
CID 58525227
N,N-diethyl-5-(4-pyridin-4-ylquinolin-6-yl)pyridine-3-sulfonamide
CID 59860014
3,5-dichloro-N-(6-morpholin-4-yl-3-pyridinyl)benzenesulfonamide
CID 25044149
N-methyl-N-phenyl-5-(4-pyridin-4-ylquinolin-6-yl)pyridine-3-sulfonamide
CID 59860008

Frequently Asked Questions

What is the IUPAC name of 6-morpholin-4-yl-N-[5-(4-pyridin-4-ylquinolin-6-yl)-3-pyridinyl]pyridine-3-sulfonamide?
The IUPAC name of 6-morpholin-4-yl-N-[5-(4-pyridin-4-ylquinolin-6-yl)-3-pyridinyl]pyridine-3-sulfonamide (CID 59859945) is 6-morpholin-4-yl-N-[5-(4-pyridin-4-ylquinolin-6-yl)-3-pyridinyl]pyridine-3-sulfonamide.
What is the SMILES notation for 6-morpholin-4-yl-N-[5-(4-pyridin-4-ylquinolin-6-yl)-3-pyridinyl]pyridine-3-sulfonamide?
The canonical SMILES for 6-morpholin-4-yl-N-[5-(4-pyridin-4-ylquinolin-6-yl)-3-pyridinyl]pyridine-3-sulfonamide is O=S(=O)(Nc1cncc(-c2ccc3nccc(-c4ccncc4)c3c2)c1)c1ccc(N2CCOCC2)nc1.
What is the InChIKey of 6-morpholin-4-yl-N-[5-(4-pyridin-4-ylquinolin-6-yl)-3-pyridinyl]pyridine-3-sulfonamide?
The InChIKey is PXDDZCZMDLDRAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H24N6O3S/c35-38(36,24-2-4-28(32-19-24)34-11-13-37-14-12-34)33-23-15-22(17-30-18-23)21-1-3-27-26(16-21)25(7-10-31-27)20-5-8-29-9-6-20/h1-10,15-19,33H,11-14H2.
What are the key properties of 6-morpholin-4-yl-N-[5-(4-pyridin-4-ylquinolin-6-yl)-3-pyridinyl]pyridine-3-sulfonamide?
6-morpholin-4-yl-N-[5-(4-pyridin-4-ylquinolin-6-yl)-3-pyridinyl]pyridine-3-sulfonamide has a molecular weight of 524.61 g/mol, XLogP of 4.39, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-morpholin-4-yl-N-[5-(4-pyridin-4-ylquinolin-6-yl)-3-pyridinyl]pyridine-3-sulfonamide is sourced from PubChem (CID 59859945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).