Drug Information

General Information
Drug ID
DR00647
Drug Name
Oxacillin
Synonyms
(2S,5R,6R)-3,3-dimethyl-6-[(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)amino]-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid; (2S,5R,6R)-3,3-dimethyl-6-{[(5-methyl-3-phenylisoxazol-4-yl)carbonyl]amino}-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid; (5-methyl-3-phenyl-4-isoxazolyl)penicillin; 2,2-dimethyl-6beta-(5-methyl-3-phenyl-1,2-oxazole-4-carboxamido)penam-3alpha-carboxylic acid; 5-Methyl-3-phenyl-4-isoxazolyl-penicillin; 6beta-(5-methyl-3-phenylisoxazol-4-yl)penicillanic acid; Bactocill; Bactocill (TN); MPI-penicillin; MPi-PC; OXACILLIN SODIUM; Ossacillina; Ossacillina [DCIT]; Oxacilina; Oxacilina (TN); Oxacilina [INN-Spanish]; Oxacillin (INN); Oxacillin [INN:BAN]; Oxacillin, Monosodium Salt, Anhydrous; Oxacilline; Oxacilline [INN-French]; Oxacillinum; Oxacillinum [INN-Latin]; Oxazocillin; Oxazocilline; Penicillin, Methylphenylisoxazolyl; Prostaphlin; Prostaphlyn; Sodium oxacillin
Drug Type
Small molecular drug
Therapeutic Class
Antibiotics
Structure
3D MOL 2D MOL
Formula
C19H19N3O5S
Canonical SMILES
CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NC3C4N(C3=O)C(C(S4)(C)C)C(=O)O
InChI
InChI=1S/C19H19N3O5S/c1-9-11(12(21-27-9)10-7-5-4-6-8-10)15(23)20-13-16(24)22-14(18(25)26)19(2,3)28-17(13)22/h4-8,13-14,17H,1-3H3,(H,20,23)(H,25,26)/t13-,14+,17-/m1/s1
InChIKey
UWYHMGVUTGAWSP-JKIFEVAISA-N
CAS Number
CAS 66-79-5
Pharmaceutical Properties Molecular Weight 401.4 Topological Polar Surface Area 138
Heavy Atom Count 28 Rotatable Bond Count 4
Hydrogen Bond Donor Count 2 Hydrogen Bond Acceptor Count 7
XLogP
2.4
PubChem CID
6196
PubChem SID
103215636 ,104133798 ,104311373 ,124766053 ,129432415 ,134223022 ,134337736 ,134972946 ,136357169 ,137003784 ,139694323 ,144224285 ,160964057 ,175266996 ,175443951 ,177749334 ,179296061 ,223555599 ,226395922 ,24398251 ,250135015 ,252553436 ,29225194 ,46505710 ,48416356 ,50050738 ,57323249 ,637164 ,77266000 ,7980211 ,8153886 ,9541 ,96024994
ChEBI ID
ChEBI:7809
TTD Drug ID
D0MB8I

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