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328038-27-3,MFCD02705286

Catalog No.:AA00I66U

328038-27-3 | 4-(2,6-Dimethyl-morpholine-4-sulfonyl)-benzoic acid

This product is typically in stock,please click "Inquire" below or
contact us at [email protected] for pricing and availability information.

Technical Information
Properties
Literature
Request for Quotation
Download SDS

Technical Information

Catalog Number:

AA00I66U

Chemical Name:

4-(2,6-Dimethyl-morpholine-4-sulfonyl)-benzoic acid

CAS Number:

328038-27-3

Molecular Formula:

C13H17NO5S

Molecular Weight:

299.3428

MDL Number:

MFCD02705286

SMILES:

CC1OC(C)CN(C1)S(=O)(=O)c1ccc(cc1)C(=O)O

Properties

Computed Properties

Complexity:

440

Covalently-Bonded Unit Count:

1

Defined Atom Stereocenter Count:

0

Defined Bond Stereocenter Count:

0

Formal Charge:

0

Heavy Atom Count:

20

Hydrogen Bond Acceptor Count:

6

Hydrogen Bond Donor Count:

1

Isotope Atom Count:

0

Rotatable Bond Count:

3

Undefined Atom Stereocenter Count:

2

Undefined Bond Stereocenter Count:

0

XLogP3:

1.1

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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SDS

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Tags:328038-27-3 Molecular Formula|328038-27-3 MDL|328038-27-3 SMILES|328038-27-3 4-(2,6-Dimethyl-morpholine-4-sulfonyl)-benzoic acid

Catalog No.: AA00I66U

328038-27-3,MFCD02705286

328038-27-3 | 4-(2,6-Dimethyl-morpholine-4-sulfonyl)-benzoic acid

This product is typically in stock,please click "Inquire" below or contact us at [email protected]for pricing and availability information.

Inquire

Technical Information

Catalog Number: AA00I66U

Chemical Name: 4-(2,6-Dimethyl-morpholine-4-sulfonyl)-benzoic acid

CAS Number: 328038-27-3

Molecular Formula: C13H17NO5S

Molecular Weight: 299.3428

MDL Number: MFCD02705286

SMILES: CC1OC(C)CN(C1)S(=O)(=O)c1ccc(cc1)C(=O)O

Properties

Complexity: 440

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 20

Hydrogen Bond Acceptor Count: 6

Hydrogen Bond Donor Count: 1

Isotope Atom Count: 0

Rotatable Bond Count: 3

Undefined Atom Stereocenter Count: 2

Undefined Bond Stereocenter Count: 0

XLogP3: 1.1

Literature fold

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters20101101

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology20060501

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