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205242-62-2 | Morpholine, 2-[[[3-(4-morpholinylmethyl)-2H-1-benzopyran-8-yl]oxy]methyl]-, (2R)-, methanesulfonate (1:1)
CAS No: 205242-62-2 Catalog No: AG0029Y7 MDL No:
Product Description
Catalog Number:
AG0029Y7
Chemical Name:
Morpholine, 2-[[[3-(4-morpholinylmethyl)-2H-1-benzopyran-8-yl]oxy]methyl]-, (2R)-, methanesulfonate (1:1)
CAS Number:
205242-62-2
Molecular Formula:
C20H30N2O7S
Molecular Weight:
442.5264
IUPAC Name:
methanesulfonic acid;(2R)-2-[[3-(morpholin-4-ylmethyl)-2H-chromen-8-yl]oxymethyl]morpholine
InChI:
InChI=1S/C19H26N2O4.2CH4O3S/c1-2-16-10-15(12-21-5-8-22-9-6-21)13-25-19(16)18(3-1)24-14-17-11-20-4-7-23-17;2*1-5(2,3)4/h1-3,10,17,20H,4-9,11-14H2;2*1H3,(H,2,3,4)/t17-;;/m1../s1
InChI Key:
WMRMIRRDPBKNMY-ZEECNFPPSA-N
SMILES:
C1CO[C@H](CN1)COc1cccc2c1OCC(=C2)CN1CCOCC1.CS(=O)(=O)O
Properties
Complexity:
545
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
538.165g/mol
Formal Charge:
0
Heavy Atom Count:
35
Hydrogen Bond Acceptor Count:
12
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
538.627g/mol
Monoisotopic Mass:
538.165g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
178A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
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| 5-HT1B receptor-mediated presynaptic inhibition at the calyx of Held of immature rats. | The European journal of neuroscience 20061001 |
| Analysis of the role of the 5-HT1B receptor in spatial and aversive learning in the rat. | Neuropsychopharmacology : official publication of the American College of Neuropsychopharmacology 20030901 |
| Role of extracellular serotonin levels in the effect of 5-HT1B receptor blockade. | Psychopharmacology 20030501 |
| An evaluation of the effect of NAS-181, a new selective 5-HT(1B) receptor antagonist, on extracellular 5-HT levels in rat frontal cortex. | Naunyn-Schmiedeberg's archives of pharmacology 20030201 |
| Extracellular serotonin in the prefrontal cortex is limited through terminal 5-HT(1B) autoreceptors: a microdialysis study in knockout mice. | Psychopharmacology 20020801 |
| Involvement of 5-HT1A and 5-HT1B receptors for citalopram-induced hypothermia in the rat. | Psychopharmacology 20010401 |
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