CS-1002120
Butanedioic acid, compd. with (2R)-1-azabicyclo[2.2.2]octyl N-benzoyl-N-(2-phenylethyl)carbamate 1:1
Manufacturer: ChemScene
CAS Number: 1798817-92-1
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₂₇H₃₂N₂O₇
Molecular Weight
496.55
Synonyms
None
SMILES
C(CC(O)=O)C(O)=O.O(C(N(C(=O)C1=CC=CC=C1)CCC2=CC=CC=C2)=O)[C@H]3N4CCC(C3)CC4
Tpsa
124.45
Logp
3.8857
H Acceptors
6
H Donors
2
Rotatable Bonds
8
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1798817-92-1 | N-Benzoyl-N-[2-(phenyl)ethyl]-N-carbamicAcidR-QuinuclidinolEsterSuccinicAcidSalt | A2B Chem | -- |
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SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₇H₃₂N₂O₇
Molecular Weight: 496.55
Synonyms: None
SMILES: C(CC(O)=O)C(O)=O.O(C(N(C(=O)C1=CC=CC=C1)CCC2=CC=CC=C2)=O)[C@H]3N4CCC(C3)CC4
Tpsa: 124.45
Logp: 3.8857
H Acceptors: 6
H Donors: 2
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₇H₃₂N₂O₇
Molecular Weight:
496.55
Synonyms:
None
SMILES:
C(CC(O)=O)C(O)=O.O(C(N(C(=O)C1=CC=CC=C1)CCC2=CC=CC=C2)=O)[C@H]3N4CCC(C3)CC4
Tpsa:
124.45
Logp:
3.8857
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
8
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₂₄N₆O₄
Molecular Weight: 352.39
Synonyms: None
SMILES: C(OCCOC([C@H](NCC)C(C)C)=O)N1C2=C(N=C1)C(=O)N=C(N)N2
Tpsa: 137.15
Logp: -0.1468
H Acceptors: 9
H Donors: 3
Rotatable Bonds: 9
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₂₄N₆O₄
Molecular Weight:
352.39
Synonyms:
None
SMILES:
C(OCCOC([C@H](NCC)C(C)C)=O)N1C2=C(N=C1)C(=O)N=C(N)N2
Tpsa:
137.15
Logp:
-0.1468
H Acceptors:
9
H Donors:
3
Rotatable Bonds:
9
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₃H₂₇ClO₈
Molecular Weight: 466.91
Synonyms: None
SMILES: O[C@]1(C2=CC(CC3=CC=C(O[C@H]4CCOC4)C=C3)=C(Cl)C=C2)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Tpsa: 128.84
Logp: 0.7174
H Acceptors: 8
H Donors: 5
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₃H₂₇ClO₈
Molecular Weight:
466.91
Synonyms:
None
SMILES:
O[C@]1(C2=CC(CC3=CC=C(O[C@H]4CCOC4)C=C3)=C(Cl)C=C2)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Tpsa:
128.84
Logp:
0.7174
H Acceptors:
8
H Donors:
5
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₃H₃₇ClO₁₀
Molecular Weight: 629.09
Synonyms: None
SMILES: O(C(C)=O)[C@H]1[C@@H](O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O)C2=CC(CC3=CC=C(O[C@@H]4C[C@@]5([C@](C4)(C5)[H])[H])C=C3)=C(Cl)C=C2
Tpsa: 123.66
Logp: 4.9062
H Acceptors: 10
H Donors: 0
Rotatable Bonds: 10
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₃H₃₇ClO₁₀
Molecular Weight:
629.09
Synonyms:
None
SMILES:
O(C(C)=O)[C@H]1[C@@H](O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O)C2=CC(CC3=CC=C(O[C@@H]4C[C@@]5([C@](C4)(C5)[H])[H])C=C3)=C(Cl)C=C2
Tpsa:
123.66
Logp:
4.9062
H Acceptors:
10
H Donors:
0
Rotatable Bonds:
10