Chemical Properties of Buprenorphine (CAS 52485-79-7)

Buprenorphine

PDF Excel Molecule Calculator

InChI
InChI=1S/C29H41NO4/c1-25(2,3)26(4,32)20-15-27-10-11-29(20,33-5)24-28(27)12-13-30(16-17-6-7-17)21(27)14-18-8-9-19(31)23(34-24)22(18)28/h8-9,17,20-21,24,31-32H,6-7,10-16H2,1-5H3
InChI Key
RMRJXGBAOAMLHD-UHFFFAOYSA-N
Formula
C29H41NO4
SMILES
COC12CCC3(CC1C(C)(O)C(C)(C)C)C1Cc4ccc(O)c5c4C3(CCN1CC1CC1)C2O5
Molecular Weight1
467.64
CAS
52485-79-7
Other Names
  • 6,14-Ethenomorphinan-7-methanol, 17-(cyclopropylmethyl)-«alpha»-(1,1-dimethylethyl)-4,5-epoxy-18,19-dihydro-3-hydroxy-6-methoxy-«alpha»-methyl-, (5-«alpha»,7-«alpha»-(S))-
  • RX 6029M
  • Temgesic
  • [5«alpha»,7«alpha»(S)]-17-(Cyclopropylmethyl)-«alpha»-(1,1-dimethylethyl)-4,5-epoxy-18,19-dihydro-3-hydroxy-6-methoxy-«alpha»-methyl-6,14-ethenomorphinan-7-methanol
  • 17-(Cyclopropylmethyl)-«alpha»-(1,1-dimethylethyl)-4,5-epoxy-18,19-dihydro-6-methoxy-«alpha»-methyl-6,14-ethenomorphinan-7-methanol
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
log10WS -5.72 Crippen Calculated Property
logPoct/wat 4.414 Crippen Calculated Property
McVol 364.010 ml/mol McGowan Calculated Property

Similar Compounds

Nalmefene. Strychnine. 3-O,6-O,N-Triacetylnormorphine. Benzylmorphine. Nicocodine. Dihydroergokryptine. Crinan-11-ol, 1,2-didehydro-3-methoxy-, (3«beta»,5«alpha»,11R,13«beta»,19«alpha»)-. [2,2'-Bimorphinan]-3,3',6,6'-tetrol, 7,7',8,8'-tetradehydro-4,5:4',5'-diepoxy-17,17'-dimethyl-, (5«alpha»,6«alpha»)-(5'«alpha»,6'«alpha»)-. Morphinan-3,6-diol, 7,8-didehydro-4,5-epoxy-17-methyl- (5«alpha»,6«alpha»)-, bis(trifluoroacetate) (ester). Triazolo[4,5-d]pyrimidin-7-ol,3h-v-, 5-amino-3-(2',3'-o-isopropylidene-beta-d-ribofuranosyl)-, 5'-diphenyl phosphate (keto form). Deserpidine. Paclitaxel. Ergotaman-3',6',18-trione, 9,10-dihydro-12'-hydroxy-2'-methyl-5'-(phenylmethyl)-, (5'«alpha»,10«alpha»)-. Ergotamine. Ergocristine.

Find more compounds similar to Buprenorphine.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.

Login Register