Basic information
- Standard SMILES
COc1ccc(C[C@@H]2NCCc3cc(OC)c(OC)cc32)cc1OC- InChIKey
YXWQTVWJNHKSCC-INIZCTEOSA-N- Molecular formula
- C20H25NO4
- Average molar mass
- 343.4 g/mol
- Monoisotopic mass
- 343.17835828
Overview
(S)-tetrahydropapaverine is the S-enantiomer of tetrahydropapaverine. It is an enantiomer of a (R)-tetrahydropapaverine.
Names & identifiers
- Preferred name
- (1~{s})-1-[(3,4-Dimethoxyphenyl)methyl]-6,7-Dimethoxy-1,2,3,4-Tetrahydroisoquinoline
- IUPAC
- (1S)-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
- English name
- (S)-(-)-Tetrahydropapaverine
- Molecular formula
- C20H25NO4
- Molecular weight
- 343.42
Names & synonyms
4747-98-2(S)-(-)-Tetrahydropapaverine(S)-Nor Laudanosine(S)-tetrahydropapaverine(1S)-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline(1~{s})-1-[(3,4-Dimethoxyphenyl)methyl]-6,7-Dimethoxy-1,2,3,4-Tetrahydroisoquinoline(S)-1-(3,4-DIMETHOXYBENZYL)-6,7-DIMETHOXY-1,2,3,4-TETRAHYDROISOQUINOLINECisatracurium Besylate Impurity 46(S)-Norlaudanosine(1S)-1-(3,4-Dimethoxy-benzyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline(-)-TetrahydropapaverineNorlaudanosins
Show more names
Cilnidipine Impurity 19Cisatracurium Besilate Impurity 23S-Tetrahydropapaveroline (N-acetyl-L-leucinate salt)(1S)-1,2,3,4-Tetrahydro-6,7-dimethoxy-1α-(3,4-dimethoxybenzyl)isoquinoline[1S,(-)]-6,7-Dimethoxy-1-(3,4-dimethoxybenzyl)-1,2,3,4-tetrahydroisoquinoline(1S)-1-[(3,4-Dimethoxyphenyl)methyl]-1,2,3,4-tetrahydro-6,7-dimethoxyisoquinoline(1S)-1,2,3,4-tetrahydro-6,7-dimethoxy -1-[(3,4-dimethoxyphenyl)methyl]Isoquinoline
S9TS-TetrahydropapaverineAtracurium Impurity N8SCHEMBL251076(R)-1-(3,4-Dimethoxybenzyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolineSCHEMBL29375914DTXSID50348641CHEBI:195379
Database identifiers
- CAS
4747-98-2- PubChem CID
- 639354
- DTXSID
DTXSID50348641- ChEBI
CHEBI:195379- Nikkaji
- J390.169F
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 49 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 407
Physicochemical properties
- Melting point
- 80 · 80-82 °C
- Boiling point
- 475.8 · 475.8±45.0 °C(Predicted)
- Density
- 1.12 · 1.120
- solubility
- Chloroform, DMSO, Methanol
- form
- Solid
- pka
- 8.66 · 8.66±0.40(Predicted)
- color
- White
Chemistry & industry
Applications
UsesUsed in the enantioselective synthesis of (+)-(S)-Laudanosine (L178525) and (-)-(S)-Xylopinine.
Uses(S)-(-)-Tetrahydropapaverine can be used in the enantioselective.
Upstream & downstream products
Upstream raw materials
Suppliers17 total
北京华威锐科化工有限公司0757-86329057 18934348241 · [email protected]
安耐吉化学&3A(安徽泽升科技有限公司)021-58432009 400-005-6266 · [email protected]
山东沃德森生物科技有限公司0531-88723173 18596073690 · [email protected]
宝鸡缔都医药化工有限公司029-81145305 17791533577 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
南京熙泽医药科技有限公司025-66023220 15250997978 · [email protected]
上海昕化医药科技有限公司021-50211651 13651607026
上海思达医药化工科技有限公司021-58521787 17701827760
上海超岚化工科技中心QQ:65489617 13301690235 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
深圳博泰尔生物技术有限公司13316949107 13316968096 · [email protected]
湖北摩科化学有限公司18627753421; 18627756402 · [email protected]
陕西缔都医药化工有限公司+86-29-81139210 17389186172 · [email protected]
深圳瑞恺德生物科技有限公司0755-61348847 17820674378 · [email protected]
重庆卡兰医药有限公司[email protected]
上海相辉医药科技有限公司13611835272 13611835272 · [email protected]
上海择睿生物科技有限公司021-54580889 18321124657 · [email protected]
Related reactions
10 records
Linked notes
Loading…