CC(C)(C)OC(=O)N(CCOC)CC1=CN=C(C=C1)C2=CC3=NC=CC(=C3S2)OC4=C(C=C(C=C4)N)F
CAS: 1123837-34-2
الاسم: tert-butyl N-[[6-[7-(4-amino-2-fluorophenoxy)thieno[3,2-b]pyridin-2-yl]-3-pyridinyl]methyl]-N-(2-methoxyethyl)carbamate
SMILES: CC(C)(C)OC(=O)N(CCOC)CC1=CN=C(C=C1)C2=CC3=NC=CC(=C3S2)OC4=C(C=C(C=C4)N)F

Molecular Processing

Molecular formula
C27H29FN4O4S
Molecular weight
524.62
Exact mass
524.1894
XLogP
6.26
TPSA
99.8
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
8
Heavy atoms
37
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.296
Molar refractivity
142.26

Supplementary Information

InChIKey: MJTZFEDWIWIDTI-UHFFFAOYSA-N
مرادفات
1123837-34-24-[[2-[5-[[Boc(2-methoxyethyl)amino]methyl]-2-pyridyl]-7-thieno[3,2-b]pyridyl]oxy]-3-fluoroanilineMFCD32876840tert-Butyl ((6-(7-(4-amino-2-fluorophenoxy)thieno[3,2-b]pyridin-2-yl)pyridin-3-yl)methyl)(2-methoxyethyl)carbamateSCHEMBL106738C27H29FN4O4SSCHEMBL29699215MJTZFEDWIWIDTI-UHFFFAOYSA-NSY278237E86376tert-Butyl (6-(7-(4-amino-2-fluorophenoxy)thieno[3,2-b]pyridin-2-yl)pyridin-3-yl)-methyl(2-methoxyethyl)carbamatetert-Butyl (6-(7-(4-amino-2-fluorophenoxy)thieno[3,2-b]pyridin-2-yl)pyridin-3-yl)methyl(2-methoxyethyl)carbamatetert-butyl N-[[6-[7-(4-amino-2-fluoro-phenoxy)thieno[3,2-b]pyridin-2-yl]-3-pyridyl]methyl]-N-(2-methoxyethyl)carbamatetert-Butyl(6-(7-(4-amino-2-fluorophenoxy)thieno[3,2-b]pyridin-2-yl)pyridin-3-yl)methyl(2-methoxyethyl)carbamate
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