CS-0914226
ethyl 4-(2,8-dichloro-5,6-dihydro-11H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-ylidene)piperidine-1-carboxylate
Manufacturer: ChemScene
CAS Number: 165739-64-0
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Purity
95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₂₂H₂₂Cl₂N₂O₂
Molecular Weight
417.33
Synonyms
None
SMILES
O=C(OCC)N1CCC(=C2C=3N=C(Cl)C=CC3CCC=4C=C(Cl)C=CC24)CC1
Tpsa
42.43
Logp
5.5412
H Acceptors
3
H Donors
0
Rotatable Bonds
1
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 165739-64-0 | 2-ChloroLoratadine | 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: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₂H₂₂Cl₂N₂O₂
Molecular Weight: 417.33
Synonyms: None
SMILES: O=C(OCC)N1CCC(=C2C=3N=C(Cl)C=CC3CCC=4C=C(Cl)C=CC24)CC1
Tpsa: 42.43
Logp: 5.5412
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 1
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₂H₂₂Cl₂N₂O₂
Molecular Weight:
417.33
Synonyms:
None
SMILES:
O=C(OCC)N1CCC(=C2C=3N=C(Cl)C=CC3CCC=4C=C(Cl)C=CC24)CC1
Tpsa:
42.43
Logp:
5.5412
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₉H₂₈N₄S
Molecular Weight: 344.52
Synonyms: None
SMILES: C(N1CCN(C=2C=3C(SN2)=CC=CC3)CC1)[C@H]4[C@H](CN)CCCC4
Tpsa: 45.39
Logp: 3.1834
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₉H₂₈N₄S
Molecular Weight:
344.52
Synonyms:
None
SMILES:
C(N1CCN(C=2C=3C(SN2)=CC=CC3)CC1)[C@H]4[C@H](CN)CCCC4
Tpsa:
45.39
Logp:
3.1834
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₈H₃₆N₄O₂S
Molecular Weight: 492.68
Synonyms: None
SMILES: O=C1[C@@]2([C@@]([C@@]3(C[C@]2(CC3)[H])[H])(C(=O)N1C[C@H]4[C@@H](CN5CCN(CC5)C=6C=7C(SN6)=CC=CC7)CCCC4)[H])[H]
Tpsa: 56.75
Logp: 4.2558
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₈H₃₆N₄O₂S
Molecular Weight:
492.68
Synonyms:
None
SMILES:
O=C1[C@@]2([C@@]([C@@]3(C[C@]2(CC3)[H])[H])(C(=O)N1C[C@H]4[C@@H](CN5CCN(CC5)C=6C=7C(SN6)=CC=CC7)CCCC4)[H])[H]
Tpsa:
56.75
Logp:
4.2558
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₃NO₃
Molecular Weight: 183.20
Synonyms: None
SMILES: C(N)(=O)[C@@H]1[C@H](C(O)=O)[C@]2(C[C@@]1(CC2)[H])[H]
Tpsa: 80.39
Logp: 0.2186
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₃NO₃
Molecular Weight:
183.20
Synonyms:
None
SMILES:
C(N)(=O)[C@@H]1[C@H](C(O)=O)[C@]2(C[C@@]1(CC2)[H])[H]
Tpsa:
80.39
Logp:
0.2186
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
2