C1=CC=C(C=C1)COC2=CC=C(C=C2)CC3=NOC(=C3)C4=C(N=C(C=C4)N)N
이름: 3-[3-[(4-phenylmethoxyphenyl)methyl]-1,2-oxazol-5-yl]pyridine-2,6-diamine
SMILES: C1=CC=C(C=C1)COC2=CC=C(C=C2)CC3=NOC(=C3)C4=C(N=C(C=C4)N)N

Molecular Processing

Molecular formula
C22H20N4O2
Molecular weight
372.43
Exact mass
372.1586
XLogP
4.07
TPSA
100.19
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
28
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.091
Molar refractivity
108.58

Supplementary Information

InChIKey: NBENCCDEAMKBEI-UHFFFAOYSA-N
동의어
SCHEMBL510356NBENCCDEAMKBEI-UHFFFAOYSA-N3-(3-(4-Benzyloxy-benzyl)-isoxazol-5-yl)-pyridin-2,6-diamine
출처 보기 →
11개 반응에 참여→

확장 검색

부분 구조 검색→유사 구조 검색→