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744227-14-3 | Methyl 3-(4-Carbamoylpiperidin-1-yl)propanoate
CAS No: 744227-14-3 Catalog No: AG01FA6P MDL No:
Product Description
Catalog Number:
AG01FA6P
Chemical Name:
Methyl 3-(4-Carbamoylpiperidin-1-yl)propanoate
CAS Number:
744227-14-3
Molecular Formula:
C10H18N2O3
Molecular Weight:
214.2615
IUPAC Name:
methyl 3-(4-carbamoylpiperidin-1-yl)propanoate
InChI:
InChI=1S/C10H18N2O3/c1-15-9(13)4-7-12-5-2-8(3-6-12)10(11)14/h8H,2-7H2,1H3,(H2,11,14)
InChI Key:
DFORLHKMYGSLEU-UHFFFAOYSA-N
SMILES:
COC(=O)CCN1CCC(CC1)C(=O)N
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.132g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
214.265g/mol
Monoisotopic Mass:
214.132g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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