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101626-70-4

101626-70-4 | 4H-Thiazolo[4,5-d]azepin-2-amine, 5,6,7,8-tetrahydro-6-(2-propen-1-yl)-

CAS No: 101626-70-4 Catalog No: AG00050T MDL No:

Product Description

Catalog Number:
AG00050T
Chemical Name:
4H-Thiazolo[4,5-d]azepin-2-amine, 5,6,7,8-tetrahydro-6-(2-propen-1-yl)-
CAS Number:
101626-70-4
Molecular Formula:
C10H15N3S
Molecular Weight:
209.3112
IUPAC Name:
6-prop-2-enyl-4,5,7,8-tetrahydro-[1,3]thiazolo[4,5-d]azepin-2-amine
InChI:
InChI=1S/C10H15N3S/c1-2-5-13-6-3-8-9(4-7-13)14-10(11)12-8/h2H,1,3-7H2,(H2,11,12)
InChI Key:
DHSSDEDRBUKTQY-UHFFFAOYSA-N
SMILES:
C=CCN1CCc2c(CC1)nc(s2)N
UNII:
7AM2J46Z1Y

Properties

Complexity:
210  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.099g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
209.311g/mol
Monoisotopic Mass:
209.099g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
70.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  

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