이름: tert-butyl 7-phenylacetamido-3-bromomethyl-3-cephem-4-carboxylate-1-oxide
SMILES:
CC(C)(C)OC(=O)C1=C(CBr)CS(=O)[C@@H]2C(NC(=O)Cc3ccccc3)C(=O)N12Molecular Processing
Molecular formula
C20H23BrN2O5S
Molecular weight
483.38
Exact mass
482.0511
XLogP
1.64
TPSA
92.78
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
29
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
3
Undefined stereo
2
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.45
Molar refractivity
112.39
Supplementary Information
상세 정보 불러오는 중…
6개 반응에 참여→