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Home > Other Heterocycles > 1461714-05-5
1461714-05-5 | 8-(5-methyl-1,3,4-thiadiazol-2-yl)-1,4-dioxa-8-azaspiro[4.5]decane
CAS No: 1461714-05-5 Catalog No: AG01A5MS MDL No:MFCD23725320
Product Description
Catalog Number:
AG01A5MS
Chemical Name:
8-(5-methyl-1,3,4-thiadiazol-2-yl)-1,4-dioxa-8-azaspiro[4.5]decane
CAS Number:
1461714-05-5
Molecular Formula:
C10H15N3O2S
Molecular Weight:
241.3100
MDL Number:
MFCD23725320
IUPAC Name:
8-(5-methyl-1,3,4-thiadiazol-2-yl)-1,4-dioxa-8-azaspiro[4.5]decane
InChI:
InChI=1S/C10H15N3O2S/c1-8-11-12-9(16-8)13-4-2-10(3-5-13)14-6-7-15-10/h2-7H2,1H3
InChI Key:
YFFOMTJKTSWCST-UHFFFAOYSA-N
SMILES:
Cc1nnc(s1)N1CCC2(CC1)OCCO2
Properties
Complexity:
250
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.088g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
241.309g/mol
Monoisotopic Mass:
241.088g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
75.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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