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Home > Other Heterocycles > 1172931-63-3
1172931-63-3 | 4-(2-THIENYLSULFONYL)-1-OXA-4,8-DIAZASPIRO[4.5]DECANE
CAS No: 1172931-63-3 Catalog No: AG01ARQQ MDL No:MFCD11987115
Product Description
Catalog Number:
AG01ARQQ
Chemical Name:
4-(2-THIENYLSULFONYL)-1-OXA-4,8-DIAZASPIRO[4.5]DECANE
CAS Number:
1172931-63-3
Molecular Formula:
C11H16N2O3S2
Molecular Weight:
288.3863
MDL Number:
MFCD11987115
IUPAC Name:
4-thiophen-2-ylsulfonyl-1-oxa-4,8-diazaspiro[4.5]decane
InChI:
InChI=1S/C11H16N2O3S2/c14-18(15,10-2-1-9-17-10)13-7-8-16-11(13)3-5-12-6-4-11/h1-2,9,12H,3-8H2
InChI Key:
MLPFGQJHLOKKQU-UHFFFAOYSA-N
SMILES:
O=S(=O)(N1CCOC21CCNCC2)c1cccs1
Properties
Complexity:
401
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.06g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
288.38g/mol
Monoisotopic Mass:
288.06g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
95.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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