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127408-31-5 | Acetamide, N-[(3S,4R)-6-cyano-3,4-dihydro-3-hydroxy-2,2-dimethyl-2H-1-benzopyran-4-yl]-N-hydroxy-
CAS No: 127408-31-5 Catalog No: AG000X21 MDL No:MFCD00888284
Product Description
Catalog Number:
AG000X21
Chemical Name:
Acetamide, N-[(3S,4R)-6-cyano-3,4-dihydro-3-hydroxy-2,2-dimethyl-2H-1-benzopyran-4-yl]-N-hydroxy-
CAS Number:
127408-31-5
Molecular Formula:
C14H16N2O4
Molecular Weight:
276.2878
MDL Number:
MFCD00888284
IUPAC Name:
N-[(3S,4R)-6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl]-N-hydroxyacetamide
InChI:
InChI=1S/C14H16N2O4/c1-8(17)16(19)12-10-6-9(7-15)4-5-11(10)20-14(2,3)13(12)18/h4-6,12-13,18-19H,1-3H3/t12-,13+/m1/s1
InChI Key:
IWTCFIIOUXJOOV-OLZOCXBDSA-N
SMILES:
N#Cc1ccc2c(c1)[C@@H](N(C(=O)C)O)[C@@H](C(O2)(C)C)O
UNII:
Q9F3XV8A6X
Properties
Complexity:
442
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
276.111g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
276.292g/mol
Monoisotopic Mass:
276.111g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
93.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
Literature
| Title | Journal |
|---|---|
| Inhibitory effects of eicosapentaenoic acid on chronic cerebral vasospasm after subarachnoid hemorrhage: possible involvement of a sphingosylphosphorylcholine-rho-kinase pathway. | Cerebrovascular diseases (Basel, Switzerland) 20080101 |
| Capsaicin-induced, capsazepine-insensitive relaxation of the guinea-pig ileum. | European journal of pharmacology 20060113 |
| Y-26763: ATP-sensitive K+ channel activation and the inhibition of insulin release from human pancreatic beta-cells. | European journal of pharmacology 20040220 |
| Chronic administration of a tyrosine kinase inhibitor restores functional and morphological changes of the basilar artery during chronic hypertension. | Journal of hypertension 20021101 |
| Suppression of airway hyperresponsiveness induced by ovalbumin sensitisation and RSV infection with Y-27632, a Rho kinase inhibitor. | Thorax 20020601 |
| Long-term effects of benidipine on cerebral vasoreactivity in hypertensive rats. | European journal of pharmacology 20020308 |
| Role of potassium channels in halothane-epinephrine arrhythmias. | Research communications in molecular pathology and pharmacology 19980601 |
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