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Home Other Building Blocks tert-butyl N-(1-carbamothioylpiperidin-4-yl)carbamate

tert-butyl N-(1-carbamothioylpiperidin-4-yl)carbamate

CAS No.:
848498-90-8
Catalog Number:
AG01B1KG
Molecular Formula:
C11H21N3O2S
Molecular Weight:
259.3683
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Product Description
Catalog Number:
AG01B1KG
Chemical Name:
tert-butyl N-(1-carbamothioylpiperidin-4-yl)carbamate
CAS Number:
848498-90-8
Molecular Formula:
C11H21N3O2S
Molecular Weight:
259.3683
MDL Number:
MFCD24470050
IUPAC Name:
tert-butyl N-(1-carbamothioylpiperidin-4-yl)carbamate
InChI:
InChI=1S/C11H21N3O2S/c1-11(2,3)16-10(15)13-8-4-6-14(7-5-8)9(12)17/h8H,4-7H2,1-3H3,(H2,12,17)(H,13,15)
InChI Key:
UQYHBRIBFPNSTA-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NC1CCN(CC1)C(=S)N
Properties
Complexity:
294  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.135g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
259.368g/mol
Monoisotopic Mass:
259.135g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
99.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties