CS-1001586
Tolvaptan Impurity 1
Manufacturer: ChemScene
CAS Number: 150683-27-5
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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
C₂₅H₂₃ClN₂O₃
Molecular Weight
434.91
Synonyms
None
SMILES
O=C(NC1=CC=C(C=C1)C(=O)N2C3=CC=C(Cl)C=C3C(O)CCC2)C=4C=CC=CC4C
Tpsa
69.64
Logp
5.37472
H Acceptors
3
H Donors
2
Rotatable Bonds
3
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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: C₂₅H₂₃ClN₂O₃
Molecular Weight: 434.91
Synonyms: None
SMILES: O=C(NC1=CC=C(C=C1)C(=O)N2C3=CC=C(Cl)C=C3C(O)CCC2)C=4C=CC=CC4C
Tpsa: 69.64
Logp: 5.37472
H Acceptors: 3
H Donors: 2
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:
C₂₅H₂₃ClN₂O₃
Molecular Weight:
434.91
Synonyms:
None
SMILES:
O=C(NC1=CC=C(C=C1)C(=O)N2C3=CC=C(Cl)C=C3C(O)CCC2)C=4C=CC=CC4C
Tpsa:
69.64
Logp:
5.37472
H Acceptors:
3
H Donors:
2
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: C₂₇H₂₇ClN₂O₃
Molecular Weight: 462.97
Synonyms: None
SMILES: O=C(NC1=CC=C(C(=O)N2C3=CC=C(Cl)C=C3C(OC)CCC2)C(=C1)C)C=4C=CC=CC4C
Tpsa: 58.64
Logp: 6.33724
H Acceptors: 3
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:
C₂₇H₂₇ClN₂O₃
Molecular Weight:
462.97
Synonyms:
None
SMILES:
O=C(NC1=CC=C(C(=O)N2C3=CC=C(Cl)C=C3C(OC)CCC2)C(=C1)C)C=4C=CC=CC4C
Tpsa:
58.64
Logp:
6.33724
H Acceptors:
3
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: C₁₄H₇Cl₂NO₃
Molecular Weight: 308.12
Synonyms: None
SMILES: O=C(O)C=1C=CC=2N=C(OC2C1)C3=CC=C(Cl)C(Cl)=C3
Tpsa: 63.33
Logp: 4.4998
H Acceptors: 3
H Donors: 1
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:
C₁₄H₇Cl₂NO₃
Molecular Weight:
308.12
Synonyms:
None
SMILES:
O=C(O)C=1C=CC=2N=C(OC2C1)C3=CC=C(Cl)C(Cl)=C3
Tpsa:
63.33
Logp:
4.4998
H Acceptors:
3
H Donors:
1
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: C₉H₇ClN₂O₂
Molecular Weight: 210.62
Synonyms: None
SMILES: O=C(O)CC1=C(Cl)N=C2C=CC=CN21
Tpsa: 54.6
Logp: 1.6148
H Acceptors: 3
H Donors: 1
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:
C₉H₇ClN₂O₂
Molecular Weight:
210.62
Synonyms:
None
SMILES:
O=C(O)CC1=C(Cl)N=C2C=CC=CN21
Tpsa:
54.6
Logp:
1.6148
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2