N-benzyl-3-morpholin-4-ylsulfonyl-N-phenylbenzamide

C24H24N2O4S — CID 26731438

IUPACN-benzyl-3-morpholin-4-ylsulfonyl-N-phenylbenzamide
SMILESO=C(c1cccc(S(=O)(=O)N2CCOCC2)c1)N(Cc1ccccc1)c1ccccc1
InChIInChI=1S/C24H24N2O4S/c27-24(26(22-11-5-2-6-12-22)19-20-8-3-1-4-9-20)21-10-7-13-23(18-21)31(28,29)25-14-16-30-17-15-25/h1-13,18H,14-17,19H2
InChIKeyCEVCQGATMWLOBR-UHFFFAOYSA-N
MW436.53 g/mol
LogP3.55
Rot. Bonds6

About N-benzyl-3-morpholin-4-ylsulfonyl-N-phenylbenzamide

N-benzyl-3-morpholin-4-ylsulfonyl-N-phenylbenzamide (PubChem CID 26731438) has the molecular formula C24H24N2O4S and a molecular weight of 436.53 g/mol. Its IUPAC name is N-benzyl-3-morpholin-4-ylsulfonyl-N-phenylbenzamide.

Molecular Properties

Compound NameN-benzyl-3-morpholin-4-ylsulfonyl-N-phenylbenzamide
PubChem CID26731438
Molecular FormulaC24H24N2O4S
Molecular Weight436.53 g/mol
Exact Mass436.15
IUPAC NameN-benzyl-3-morpholin-4-ylsulfonyl-N-phenylbenzamide
SMILESO=C(c1cccc(S(=O)(=O)N2CCOCC2)c1)N(Cc1ccccc1)c1ccccc1
InChIInChI=1S/C24H24N2O4S/c27-24(26(22-11-5-2-6-12-22)19-20-8-3-1-4-9-20)21-10-7-13-23(18-21)31(28,29)25-14-16-30-17-15-25/h1-13,18H,14-17,19H2
InChIKeyCEVCQGATMWLOBR-UHFFFAOYSA-N
XLogP3.55
TPSA66.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.53
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-benzyl-N-(2-methoxyethyl)-3-morpholin-4-ylsulfonylbenzamide
CID 9094422
N-(furan-2-ylmethyl)-N-(4-methylphenyl)-3-morpholin-4-ylsulfonylbenzamide
CID 2160971
N-benzyl-4-methyl-N-(3-methylphenyl)-3-morpholin-4-ylsulfonylbenzamide
CID 25163174
N-benzyl-4-methoxy-N-(4-methylphenyl)-3-morpholin-4-ylsulfonylbenzamide
CID 24979784
N'-methyl-3-morpholin-4-ylsulfonyl-N'-phenylbenzohydrazide
CID 9479543
2-(benzylamino)-1-(3-morpholin-4-ylsulfonylphenyl)ethanone
CID 110824752
N-benzyl-3-(4-benzylpiperazin-1-yl)sulfonyl-N-methylbenzamide
CID 39230100
2-[(3-morpholin-4-ylsulfonylbenzoyl)amino]acetic acid
CID 24691198
phenyl 3-morpholin-4-ylsulfonylbenzoate
CID 2679267
N-[(2R)-2-hydroxy-2-phenylethyl]-3-morpholin-4-ylsulfonylbenzamide
CID 1256857
N-cyclopentyl-N-cyclopropyl-3-morpholin-4-ylsulfonylbenzamide
CID 52568346
4-[3-[(4-benzylpiperazin-1-yl)methyl]phenyl]sulfonylmorpholine
CID 8902409

Frequently Asked Questions

What is the IUPAC name of N-benzyl-3-morpholin-4-ylsulfonyl-N-phenylbenzamide?
The IUPAC name of N-benzyl-3-morpholin-4-ylsulfonyl-N-phenylbenzamide (CID 26731438) is N-benzyl-3-morpholin-4-ylsulfonyl-N-phenylbenzamide.
What is the SMILES notation for N-benzyl-3-morpholin-4-ylsulfonyl-N-phenylbenzamide?
The canonical SMILES for N-benzyl-3-morpholin-4-ylsulfonyl-N-phenylbenzamide is O=C(c1cccc(S(=O)(=O)N2CCOCC2)c1)N(Cc1ccccc1)c1ccccc1.
What is the InChIKey of N-benzyl-3-morpholin-4-ylsulfonyl-N-phenylbenzamide?
The InChIKey is CEVCQGATMWLOBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O4S/c27-24(26(22-11-5-2-6-12-22)19-20-8-3-1-4-9-20)21-10-7-13-23(18-21)31(28,29)25-14-16-30-17-15-25/h1-13,18H,14-17,19H2.
What are the key properties of N-benzyl-3-morpholin-4-ylsulfonyl-N-phenylbenzamide?
N-benzyl-3-morpholin-4-ylsulfonyl-N-phenylbenzamide has a molecular weight of 436.53 g/mol, XLogP of 3.55, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-3-morpholin-4-ylsulfonyl-N-phenylbenzamide is sourced from PubChem (CID 26731438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).