CS-1002610
Ethyl 4-(8-chloro-6,11-dihydro-11-hydroxy-5H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-yl)-4-hydroxy-1-piperidinecarboxylate
Manufacturer: ChemScene
CAS Number: 212831-12-4
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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
C₂₂H₂₅ClN₂O₄
Molecular Weight
416.90
Synonyms
None
SMILES
O=C(OCC)N1CCC(O)(CC1)C2(O)C3=NC=CC=C3CCC4=CC(Cl)=CC=C42
Tpsa
82.89
Logp
3.0529
H Acceptors
5
H Donors
2
Rotatable Bonds
2
SAFETY INFORMATION
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: C₂₂H₂₅ClN₂O₄
Molecular Weight: 416.90
Synonyms: None
SMILES: O=C(OCC)N1CCC(O)(CC1)C2(O)C3=NC=CC=C3CCC4=CC(Cl)=CC=C42
Tpsa: 82.89
Logp: 3.0529
H Acceptors: 5
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:
C₂₂H₂₅ClN₂O₄
Molecular Weight:
416.90
Synonyms:
None
SMILES:
O=C(OCC)N1CCC(O)(CC1)C2(O)C3=NC=CC=C3CCC4=CC(Cl)=CC=C42
Tpsa:
82.89
Logp:
3.0529
H Acceptors:
5
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: C₃₁H₄₁NO₄
Molecular Weight: 491.66
Synonyms: None
SMILES: O(C(C)=O)[C@@]1(C(C)=O)[C@]2(C)[C@@](CC1)([C@]3([C@](CC2)([C@]4(C)C(C(CN(C)C5=CC=CC=C5)C3)=CC(=O)CC4)[H])[H])[H]
Tpsa: 63.68
Logp: 5.7717
H Acceptors: 5
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:
C₃₁H₄₁NO₄
Molecular Weight:
491.66
Synonyms:
None
SMILES:
O(C(C)=O)[C@@]1(C(C)=O)[C@]2(C)[C@@](CC1)([C@]3([C@](CC2)([C@]4(C)C(C(CN(C)C5=CC=CC=C5)C3)=CC(=O)CC4)[H])[H])[H]
Tpsa:
63.68
Logp:
5.7717
H Acceptors:
5
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: C₂₁H₂₇NO₂
Molecular Weight: 325.44
Synonyms: None
SMILES: C([C@H](C[C@H](C(OC(C)C)=O)C)N)C1=CC=C(C=C1)C2=CC=CC=C2
Tpsa: 52.32
Logp: 4.2012
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₁H₂₇NO₂
Molecular Weight:
325.44
Synonyms:
None
SMILES:
C([C@H](C[C@H](C(OC(C)C)=O)C)N)C1=CC=C(C=C1)C2=CC=CC=C2
Tpsa:
52.32
Logp:
4.2012
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
7
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₉H₁₃Cl₂NO₄
Molecular Weight: 390.22
Synonyms: None
SMILES: O=C(O)C1=C(Cl)C=C2C(=C1Cl)CCN(C(=O)C=3C=CC=4C=COC4C3)C2
Tpsa: 70.75
Logp: 4.6363
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₉H₁₃Cl₂NO₄
Molecular Weight:
390.22
Synonyms:
None
SMILES:
O=C(O)C1=C(Cl)C=C2C(=C1Cl)CCN(C(=O)C=3C=CC=4C=COC4C3)C2
Tpsa:
70.75
Logp:
4.6363
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2