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LY3000328

CAS No.:
1373215-15-6
Catalog Number:
AG009C1G
Molecular Formula:
C25H29FN4O5
Molecular Weight:
484.5200
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
99%
1 week
United States
$437
- +
10mg
99%
1 week
United States
$548
- +
50mg
99%
1 week
United States
$1776
- +
Product Description
Catalog Number:
AG009C1G
Chemical Name:
LY3000328
CAS Number:
1373215-15-6
Molecular Formula:
C25H29FN4O5
Molecular Weight:
484.5200
MDL Number:
MFCD28502827
IUPAC Name:
[(3R,4S)-4-[(4-fluorobenzoyl)amino]-6-[4-(oxetan-3-yl)piperazin-1-yl]-3,4-dihydro-2H-chromen-3-yl] N-methylcarbamate
InChI:
InChI=1S/C25H29FN4O5/c1-27-25(32)35-22-15-34-21-7-6-18(29-8-10-30(11-9-29)19-13-33-14-19)12-20(21)23(22)28-24(31)16-2-4-17(26)5-3-16/h2-7,12,19,22-23H,8-11,13-15H2,1H3,(H,27,32)(H,28,31)/t22-,23-/m0/s1
InChI Key:
NDEBZCZEAVMSQF-GOTSBHOMSA-N
SMILES:
CNC(=O)O[C@H]1COc2c([C@@H]1NC(=O)c1ccc(cc1)F)cc(cc2)N1CCN(CC1)C1COC1
UNII:
1210T8CX6K
Properties
Complexity:
739  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
484.212g/mol
Formal Charge:
0
Heavy Atom Count:
35  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
484.528g/mol
Monoisotopic Mass:
484.212g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
92.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties