CC1=CC=CC=C1NC(=O)NC2=C(C=C(C=C2)CC(=O)N(C)C3=CC=C(C=C3)C4(CCCC4)CC(=O)OC(C)(C)C)OC
الاسم: tert-butyl 2-[1-[4-[[2-[3-methoxy-4-[(2-methylphenyl)carbamoylamino]phenyl]acetyl]-methylamino]phenyl]cyclopentyl]acetate
SMILES: CC1=CC=CC=C1NC(=O)NC2=C(C=C(C=C2)CC(=O)N(C)C3=CC=C(C=C3)C4(CCCC4)CC(=O)OC(C)(C)C)OC

Molecular Processing

Molecular formula
C35H43N3O5
Molecular weight
585.75
Exact mass
585.3203
XLogP
7.4
TPSA
96.97
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
9
Heavy atoms
43
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
170.98

Supplementary Information

InChIKey: MMLFWISBQRVVBL-UHFFFAOYSA-N
مرادفات
SCHEMBL5371733MMLFWISBQRVVBL-UHFFFAOYSA-N[1-{4-[{2-[3-Methoxy-4-[3-o-tolyl-ureido]-phenyl]-acetyl}-methyl-amino]-phenyl}-cyclopentyl]-acetic acid tert-butyl ester
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