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1803571-84-7

1803571-84-7 | tert-butyl N-{2-[(1-methyl-2,3-dihydro-1H-indol-5-yl)methyl]-3-oxopropyl}carbamate

CAS No: 1803571-84-7 Catalog No: AG01BEW4 MDL No:MFCD28063803

Product Description

Catalog Number:
AG01BEW4
Chemical Name:
tert-butyl N-{2-[(1-methyl-2,3-dihydro-1H-indol-5-yl)methyl]-3-oxopropyl}carbamate
CAS Number:
1803571-84-7
Molecular Formula:
C18H26N2O3
Molecular Weight:
318.4106
MDL Number:
MFCD28063803
IUPAC Name:
tert-butyl N-[2-formyl-3-(1-methyl-2,3-dihydroindol-5-yl)propyl]carbamate
InChI:
InChI=1S/C18H26N2O3/c1-18(2,3)23-17(22)19-11-14(12-21)9-13-5-6-16-15(10-13)7-8-20(16)4/h5-6,10,12,14H,7-9,11H2,1-4H3,(H,19,22)
InChI Key:
AAAYULDZXOCSIE-UHFFFAOYSA-N
SMILES:
O=CC(Cc1ccc2c(c1)CCN2C)CNC(=O)OC(C)(C)C

Properties

Complexity:
419  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
318.194g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
318.417g/mol
Monoisotopic Mass:
318.194g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  

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