CS-0064951
3-(4-(2-(Azepan-1-yl)ethoxy)benzyl)-2-(4-hydroxyphenyl)-3-methyl-3H-indol-5-ol
Manufacturer: ChemScene
CAS Number: 2205073-29-4
The price for this product is unavailable. Please request a quote
Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₃₀H₃₄N₂O₃
Molecular Weight
470.60
Synonyms
None
SMILES
OC1=CC2=C(N=C(C3=CC=C(O)C=C3)C2(CC4=CC=C(OCCN5CCCCCC5)C=C4)C)C=C1
Tpsa
65.29
Logp
5.9874
H Acceptors
5
H Donors
2
Rotatable Bonds
7
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
Compare Similar Items
Show Difference
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₀H₃₄N₂O₃
Molecular Weight: 470.60
Synonyms: None
SMILES: OC1=CC2=C(N=C(C3=CC=C(O)C=C3)C2(CC4=CC=C(OCCN5CCCCCC5)C=C4)C)C=C1
Tpsa: 65.29
Logp: 5.9874
H Acceptors: 5
H Donors: 2
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:
C₃₀H₃₄N₂O₃
Molecular Weight:
470.60
Synonyms:
None
SMILES:
OC1=CC2=C(N=C(C3=CC=C(O)C=C3)C2(CC4=CC=C(OCCN5CCCCCC5)C=C4)C)C=C1
Tpsa:
65.29
Logp:
5.9874
H Acceptors:
5
H Donors:
2
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: C₁₇H₂₆ClNO₃
Molecular Weight: 327.85
Synonyms: None
SMILES: O=C(OC1CC(C)(C)N(C)C(C)C1)C(O)C2=CC=CC=C2.Cl
Tpsa: 49.77
Logp: 2.9463
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₂₆ClNO₃
Molecular Weight:
327.85
Synonyms:
None
SMILES:
O=C(OC1CC(C)(C)N(C)C(C)C1)C(O)C2=CC=CC=C2.Cl
Tpsa:
49.77
Logp:
2.9463
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₉H₂₅NOS
Molecular Weight: 315.47
Synonyms: ent-Rotigotine
SMILES: CCCN(CCC1=CC=CS1)[C@@H]2CCC3=C(C=CC=C3O)C2
Tpsa: 23.47
Logp: 4.2657
H Acceptors: 3
H Donors: 1
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:
C₁₉H₂₅NOS
Molecular Weight:
315.47
Synonyms:
ent-Rotigotine
SMILES:
CCCN(CCC1=CC=CS1)[C@@H]2CCC3=C(C=CC=C3O)C2
Tpsa:
23.47
Logp:
4.2657
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
6
Purity: 98%
MDL No: MFCD14525467
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₉H₂₆ClNOS
Molecular Weight: 351.93
Synonyms: RotigotineImpurity16HCl
SMILES: OC1=CC=CC2=C1CC[C@@H](N(CCC3=CC=CS3)CCC)C2.Cl
Tpsa: 23.47
Logp: 4.6875
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 6
Purity:
98%
MDL No:
MFCD14525467
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₉H₂₆ClNOS
Molecular Weight:
351.93
Synonyms:
RotigotineImpurity16HCl
SMILES:
OC1=CC=CC2=C1CC[C@@H](N(CCC3=CC=CS3)CCC)C2.Cl
Tpsa:
23.47
Logp:
4.6875
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
6