이름: 3-(7-isopropenyl-4-methyl-3-oxo-2,3,4,10-tetrahydro-9-oxa-1,2,4a-triaza-phenanthren-6-yloxy)-azetidine-1-carboxylic acid tert-butyl ester
SMILES:
C=C(C)c1cc2c(cc1OC1CN(C(=O)OC(C)(C)C)C1)N1C(=NNC(=O)C1C)CO2Molecular Processing
Molecular formula
C22H28N4O5
Molecular weight
428.49
Exact mass
428.206
XLogP
2.75
TPSA
92.7
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
3
Heavy atoms
31
Rings
4
Aromatic rings
1
Saturated rings
1
Aliphatic rings
3
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
116.39
Supplementary Information
상세 정보 불러오는 중…
2개 반응에 참여→